diff options
author | Joseph Hunkeler <jhunkeler@gmail.com> | 2021-08-03 14:41:53 -0400 |
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committer | Joseph Hunkeler <jhunkeler@gmail.com> | 2021-08-03 14:41:53 -0400 |
commit | af8fa097905186e0d8ba257e4d70d63fe8901264 (patch) | |
tree | 647de7ddd01c750e9a80849b3cf79efddf32d4b2 | |
download | moog-af8fa097905186e0d8ba257e4d70d63fe8901264.tar.gz |
Initial commit
-rw-r--r-- | .gitignore | 3 | ||||
-rwxr-xr-x | Abfind.f | 207 | ||||
-rwxr-xr-x | Abpop.f | 251 | ||||
-rwxr-xr-x | Abunplot.f | 273 | ||||
-rwxr-xr-x | Atmos.com | 62 | ||||
-rwxr-xr-x | Barklem.dat | 15935 | ||||
-rwxr-xr-x | BarklemUV.dat | 13154 | ||||
-rwxr-xr-x | Batom.f | 625 | ||||
-rwxr-xr-x | Begin.f | 138 | ||||
-rwxr-xr-x | Binary.f | 198 | ||||
-rwxr-xr-x | Binplot.f | 322 | ||||
-rwxr-xr-x | Binplotprep.f | 172 | ||||
-rwxr-xr-x | Blankstring.f | 18 | ||||
-rwxr-xr-x | Blends.f | 321 | ||||
-rwxr-xr-x | Bmolec.f | 226 | ||||
-rwxr-xr-x | Boxit.f | 59 | ||||
-rwxr-xr-x | Calmod.f | 49 | ||||
-rwxr-xr-x | Cdcalc.f | 52 | ||||
-rwxr-xr-x | Chabund.f | 253 | ||||
-rwxr-xr-x | Cog.f | 106 | ||||
-rwxr-xr-x | Cogplot.f | 123 | ||||
-rwxr-xr-x | Cogsyn.f | 102 | ||||
-rwxr-xr-x | Correl.f | 140 | ||||
-rwxr-xr-x | Crosscorr.f | 52 | ||||
-rwxr-xr-x | Curve.f | 80 | ||||
-rwxr-xr-x | Dampdat.com | 17 | ||||
-rwxr-xr-x | Damping.f | 201 | ||||
-rwxr-xr-x | Defcolor.f | 36 | ||||
-rwxr-xr-x | Discov.f | 23 | ||||
-rwxr-xr-x | Doflux.f | 91 | ||||
-rwxr-xr-x | Drawcurs.f | 51 | ||||
-rwxr-xr-x | Dummy.com | 11 | ||||
-rwxr-xr-x | Eqlib.f | 288 | ||||
-rwxr-xr-x | Equivs.com | 24 | ||||
-rwxr-xr-x | Ewfind.f | 214 | ||||
-rwxr-xr-x | Ewweighted.f | 86 | ||||
-rwxr-xr-x | Factor.com | 27 | ||||
-rwxr-xr-x | Fakeline.f | 91 | ||||
-rwxr-xr-x | Findtic.f | 36 | ||||
-rwxr-xr-x | Finish.f | 46 | ||||
-rwxr-xr-x | Fluxplot.f | 98 | ||||
-rwxr-xr-x | Gammabark.f | 103 | ||||
-rwxr-xr-x | Getasci.f | 42 | ||||
-rwxr-xr-x | Getcount.f | 24 | ||||
-rwxr-xr-x | Getnum.f | 24 | ||||
-rwxr-xr-x | Getsyns.f | 126 | ||||
-rwxr-xr-x | Gridplo.f | 90 | ||||
-rwxr-xr-x | Gridsyn.f | 156 | ||||
-rwxr-xr-x | Infile.f | 99 | ||||
-rwxr-xr-x | Inlines.f | 312 | ||||
-rwxr-xr-x | Inmodel.f | 439 | ||||
-rwxr-xr-x | Inmodel.new | 524 | ||||
-rwxr-xr-x | Invert.f | 92 | ||||
-rwxr-xr-x | Jexpint.f | 103 | ||||
-rwxr-xr-x | Kappa.com | 23 | ||||
-rwxr-xr-x | Lineabund.f | 103 | ||||
-rwxr-xr-x | Lineinfo.f | 356 | ||||
-rwxr-xr-x | Linex.com | 52 | ||||
-rwxr-xr-x | Linlimit.f | 157 | ||||
-rwxr-xr-x | Makefile.macdesk | 53 | ||||
-rwxr-xr-x | Makefile.macdesksilent | 53 | ||||
-rwxr-xr-x | Makefile.maclap | 54 | ||||
-rwxr-xr-x | Makefile.maclapsilent | 53 | ||||
-rwxr-xr-x | Makefile.rh | 52 | ||||
-rwxr-xr-x | Makefile.rh64 | 53 | ||||
-rwxr-xr-x | Makefile.rh64silent | 53 | ||||
-rwxr-xr-x | Makefile.rhsilent | 53 | ||||
-rwxr-xr-x | Makeplot.f | 123 | ||||
-rwxr-xr-x | Mol.com | 41 | ||||
-rwxr-xr-x | Molquery.f | 89 | ||||
-rwxr-xr-x | Moog.f | 117 | ||||
-rwxr-xr-x | Moogsilent.f | 113 | ||||
-rwxr-xr-x | Multimod.com | 32 | ||||
-rwxr-xr-x | Multistar.com | 20 | ||||
-rwxr-xr-x | Mydriver.f | 13 | ||||
-rwxr-xr-x | Nansi.f | 184 | ||||
-rwxr-xr-x | Nearly.f | 186 | ||||
-rwxr-xr-x | Number.f | 53 | ||||
-rwxr-xr-x | Obshead.f | 102 | ||||
-rwxr-xr-x | Obspars.com | 12 | ||||
-rwxr-xr-x | Oneline.f | 182 | ||||
-rwxr-xr-x | OpacHelium.f | 45 | ||||
-rwxr-xr-x | OpacHydrogen.f | 280 | ||||
-rwxr-xr-x | Opaccouls.f | 121 | ||||
-rwxr-xr-x | Opacit.f | 154 | ||||
-rwxr-xr-x | Opacmetals.f | 504 | ||||
-rwxr-xr-x | Opacscat.f | 104 | ||||
-rwxr-xr-x | Params.f | 813 | ||||
-rwxr-xr-x | Partfn.f | 42 | ||||
-rwxr-xr-x | Partnew.f | 40 | ||||
-rwxr-xr-x | Plotit.f | 85 | ||||
-rwxr-xr-x | Plotremember.f | 123 | ||||
-rwxr-xr-x | Plotval.com | 6 | ||||
-rwxr-xr-x | Pltabun.f | 64 | ||||
-rwxr-xr-x | Pltcog.f | 77 | ||||
-rwxr-xr-x | Pltflux.f | 45 | ||||
-rwxr-xr-x | Pltspec.f | 418 | ||||
-rwxr-xr-x | Pointcurs.f | 27 | ||||
-rwxr-xr-x | Prinfo.f | 58 | ||||
-rwxr-xr-x | Pstuff.com | 76 | ||||
-rwxr-xr-x | Putasci.f | 28 | ||||
-rwxr-xr-x | Quants.com | 13 | ||||
-rwxr-xr-x | Readobs.f | 192 | ||||
-rwxr-xr-x | Rinteg.f | 66 | ||||
-rwxr-xr-x | Setmols.f | 99 | ||||
-rwxr-xr-x | Setmols.r | 513 | ||||
-rwxr-xr-x | Smooth.f | 523 | ||||
-rwxr-xr-x | Specplot.f | 335 | ||||
-rwxr-xr-x | Stats.f | 103 | ||||
-rwxr-xr-x | Sunder.f | 24 | ||||
-rwxr-xr-x | Synpop.f | 304 | ||||
-rwxr-xr-x | Synspec.f | 182 | ||||
-rwxr-xr-x | Synth.f | 153 | ||||
-rwxr-xr-x | Tablepop.f | 171 | ||||
-rwxr-xr-x | Taukap.f | 48 | ||||
-rwxr-xr-x | Total.f | 63 | ||||
-rwxr-xr-x | Trudamp.f | 166 | ||||
-rwxr-xr-x | Ucalc.f | 60 | ||||
-rwxr-xr-x | Vargauss.f | 220 | ||||
-rwxr-xr-x | Vmacro.f | 102 | ||||
-rwxr-xr-x | Voigt.f | 70 | ||||
-rwxr-xr-x | Wavecalc.f | 59 | ||||
-rwxr-xr-x | Weedout.f | 165 | ||||
-rwxr-xr-x | Writenumber.f | 35 |
124 files changed, 45553 insertions, 0 deletions
diff --git a/.gitignore b/.gitignore new file mode 100644 index 0000000..08205a3 --- /dev/null +++ b/.gitignore @@ -0,0 +1,3 @@ +*.o +*.swp +.smhist diff --git a/Abfind.f b/Abfind.f new file mode 100755 index 0000000..9ddae84 --- /dev/null +++ b/Abfind.f @@ -0,0 +1,207 @@ + + subroutine abfind +c****************************************************************************** +c This routine derives abundances for individual atomic lines +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Pstuff.com' + + +c*****read the parameter file + call params + + +c*****open the files for standard output and summary abundances + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = lscreen + 2 + array = 'SUMMARY ABUNDANCE OUTPUT' + nchars = 24 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + nf5out = 26 + lscreen = lscreen + 2 + array = 'POSTSCRIPT PLOT OUTPUT' + nchars = 22 + call infile ('output ',nf5out,'formatted ',0,nchars, + . f5out,lscreen) + + +c*****open and read the model atmosphere + array = 'THE MODEL ATMOSPHERE' + nchars = 20 +102 nfmodel = 30 + lscreen = lscreen + 2 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****open and read the line list file; get ready for the line calculations + array = 'THE LINE LIST' + nchars = 13 + nflines = 31 + lscreen = lscreen + 2 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + + +c*****get ready for the line calculations: generate a curve-of-growth lookup +c table, read the linelist, etc. +100 call fakeline + call inlines (1) + call eqlib + call nearly (1) + + +c*****set some parameters + ewsynthopt = -1 + mode = 2 + cogatom = 0. + lim1line = 0 + + +c*****find the range of lines of a species +5 call linlimit + if (lim1line .lt. 0) then + call finish (0) + return + endif + lim1obs = lim1line + lim2obs = lim2line + + +c*****find out whether molecular equilibrium is involved in the species + call molquery + + +c*****force each abundance of a species member to predict the +c line equivalent width; here is the code for ordinary species + if (molflag .eq. 0) then + abundin = dlog10(xabund(iabatom)) + 12.0 + do lim1=lim1line,lim2line + call lineabund (abundin) + enddo + call stats + call lineinfo (3) + else + + +c*****and here is the code for species involved in molecular equilibrium; +c this procedure is iterated until input and output abundances are in +c agreement + iternumber = 1 +10 abundin = dlog10(xabund(iabatom)) + 12.0 + do lim1=lim1line,lim2line + call lineabund (abundin) + enddo + call stats + call lineinfo (3) + if (t(jtau5).lt.3800 .or. + . atom1(lim1line).gt.100.0 .or. + . int(atom1(lim1line)+0.0001).eq.6 .or. + . int(atom1(lim1line)+0.0001).eq.8) then + if (iternumber .lt. 6) then + if (dabs(average-abundin) .gt. 0.02) then + xabund(iabatom) = 10.**(average-12.) + iternumber = iternumber + 1 + call eqlib + call nearly (2) + go to 10 + else + write (array,1001) iternumber + ikount=kount+14 + nchars = 53 + call putasci (nchars,ikount) + endif + else + write (array,1003) molecule, dlog10(abundin), + . dlog10(average) + lscreen = lscreen + 2 + call prinfo (lscreen) + stop + endif + endif + endif + + +c*****here a plot may be made on the terminal (and paper) if there +c are enough lines; then the user will be prompted on some +c options concerning what is seen on the plot + if (plotopt .ne. 0) then + call pltabun + if (choice.eq.'v') then + rewind nf1out + rewind nf2out + write (nf2out,1002) linitle,moditle + choice = ' ' + go to 100 + elseif (choice .eq. 'm') then + close (unit=nfmodel) + close (unit=nflines) + rewind nf1out + rewind nf2out + rewind nf5out + array = 'THE NEW MODEL ATMOSPHERE' + nchars = 24 + fmodel = 'no_filename_given' + lim1line = 0 + lim2line = 0 + lim1obs = 0 + lim2obs = 0 + go to 102 + endif + endif + + + + +c*****quit, or go on to another species? + if (silent .eq. 'y') then + choice = 'y' + nchars = 0 + else + array = 'DO ANOTHER SPECIES ([y]/n)? ' + nchars = 28 + call getasci (nchars,maxline) + choice = chinfo(1:1) + endif + if (choice.eq.'y' .or. nchars.le.0) then + if (mode .eq. 2) then + go to 5 + else + call finish (0) + return + endif + else + call finish (0) + return + endif + + +c*****format statements +1001 format ('THIS REQUIRED', i2,' ITERATIONS WITH MOLECULAR ', + . 'EQUILIBRIUM') +1002 format (a80) +1003 format ('FOR SPECIES ', f10.1,' NO CONVERGENCE: '/ + . 'LAST ITERATIONS YIELD', 2f10.3, ' I QUIT!') + + + end + + + + + + + + @@ -0,0 +1,251 @@ + + subroutine abpop +c****************************************************************************** +c Equivalent width matching routine for stellar populations; usually +c meant for integrated light spectra. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Pstuff.com' + include 'Multimod.com' + character*80 line + + +c*****read the parameter file + call params + + +c*****open the model table input file and the summary table output file; +c read the information from the table input file + call tablepop (1) + + +c*****open the standard output file + nf1out = 20 + lscreen = 8 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + +c*****FIRST PASS: For each model, for each line, create a curve-of-growth +c finely divided in steps of 0.01 in "Ngf" + do mmod=1,modtot + + +c*****read in the model atmospheres and their summary output files + line = synpre + num = 80 + call getcount (num,line) + if (mmod .lt. 10) then + write(line(num+1:num+1),1013) mmod + else + write(line(num+1:num+2),1014) mmod + endif + nf2out = 21 + fmodoutput(mmod) = line + f2out = fmodoutput(mmod) + lscreen = 10 + array = 'SUMMARY C-O-G OUTPUT' + nchars = 20 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + + line = modpre + num = 80 + call getcount (num,line) + if (mmod .lt. 10) then + write(line(num+1:num+1),1013) mmod + else + write(line(num+1:num+2),1014) mmod + endif + nfmodel = 30 + fmodinput(mmod) = line + fmodel = fmodinput(mmod) + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + lscreen = 12 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + write (nf2out,1001) moditle + + +c*****open and read the line list; this will internally be broken down +c into 1-line lists for computational efficiency + array = 'THE LINE LIST' + nchars = 13 + nflines = 31 + lscreen = 14 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + call inlines (1) + if (nlines .gt. 1000) then + write (*,1005) + stop + endif + call eqlib + call nearly (1) + + +c*****do the curves of growth; store the results + rwlow = -6.5 + rwhigh = -3.5 + rwstep = 0.15 + do lim1=1,nlines + lim2 = lim1 + waveold = 0. + call curve + if (ncurve .gt. 50) then + nmodcurve(mmod,lim1) = 50 + else + nmodcurve(mmod,lim1) = ncurve + endif + fluxmod(mmod,lim1) = flux + lastcurve = nmodcurve(mmod,lim1) + iatom = nint(atom1(lim1)) + xxab = dlog10(xabund(iatom)) + weightmod(mmod,lim1) = fluxmod(mmod,lim1)*radius(mmod)**2* + . relcount(mmod) + do icurve=1,lastcurve + gfmodtab(mmod,lim1,icurve) = gf1(icurve) + xxab + rwmodtab(mmod,lim1,icurve) = w(icurve) + enddo + enddo + enddo + + +c*****set some parameters + ewsynthopt = -1 + mode = 2 + cogatom = 0. + lim1line = 0 + + +c*****now, inside the +c*****define the range of lines for a species + 5 call linlimit + if (lim1line .lt. 0) then + call finish (0) + return + endif + lim1obs = lim1line + lim2obs = lim2line + + +c*****find out whether molecular equilibrium is involved in the species + call molquery + + +c*****for just the first model atmosphere, interpolate in the curve-of-growth +c at very small log(Ngf) steps for just the first line in the list, +c in order to make a lookup table for later abundance iterations + ncurve = nmodcurve(1,1) + do i=2,ncurve-2 + k = 30*(i-2) + l = -1 + do m=k+1,k+30 + l = l + 1 + pp = 0.005/0.15*(l-1) + gftab(m) = gfmodtab(1,1,2) + 0.005*(m-1) + rwtab(m) = rwmodtab(1,1,i-1)*(-pp)*(pp-1.)*(pp-2.)/6. + + . rwmodtab(1,1,i)*(pp*pp-1.)*(pp-2.)/2. + + . rwmodtab(1,1,i+1)*(-pp)*(pp+1.)*(pp-2.)/2. + + . rwmodtab(1,1,i+2)*pp*(pp*pp-1.)/6. + enddo + enddo + ntabtot = m - 1 + + +c*****now consider each line at a time; use these curve-of-growth to +c compute a weighted <EW_calc> + do lim1=lim1line,lim2line + write (nf7out,1003) atom1(lim1), wave1(lim1), e(lim1,1), + . dlog10(gf(lim1)) + rwlgerror = 50. + deltangf = 0. + do k=1,30 + call ewweighted + rwlgcal = dlog10(ewmod(lim1)/wave1(lim1)) + do i=2,ntabtot + if (rwtab(i) .gt. rwlgcal) then + gflgcal = gftab(i-1) + (gftab(i)-gftab(i-1))* + . (rwlgcal-rwtab(i-1))/(rwtab(i)-rwtab(i-1)) + exit + endif + enddo + rwlgobs = dlog10(width(lim1)/wave1(lim1)) + do i=2,ntabtot + if (rwtab(i) .gt. rwlgobs) then + gflgobs = gftab(i-1) + (gftab(i)-gftab(i-1))* + . (rwlgobs-rwtab(i-1))/(rwtab(i)-rwtab(i-1)) + exit + endif + enddo + rwlgerror = rwlgobs - rwlgcal + diffngf = gflgobs - gflgcal + deltangf = deltangf + diffngf + if (dabs(rwlgerror) .lt. 0.01) exit + if (k .eq. 30) then + write (*,1004) + stop + endif + enddo + + +c*****here we go for a final iteration on a line, or finish + call ewweighted + enddo + + +c*****do the species statistics and output the results + call stats + call lineinfo (3) + + +c*****here a plot may be made on the terminal (and paper) if there +c are enough lines; then the user will be prompted on some +c options concerning what is seen on the plot + + if (plotopt .ne. 0) then + call blankstring (moditle) + moditle(1:70) = popitle(1:70) + moditle(57:80) = 'EW-POPULATION ' + call pltabun + endif + + +*****quit, or go on to another species? + array = 'DO ANOTHER SPECIES ([y]/n)? ' + if (silent .eq. 'n') then + nchars = 28 + call getasci (nchars,maxline) + choice = chinfo(1:1) + else + choice = 'y' + endif + if (choice.eq.'y' .or. nchars.le.0) then + if (mode .eq. 2) then + go to 5 + else + call finish (0) + return + endif + else + call finish (0) + return + endif + + +c*****format statements +1001 format (a80) +1003 format (/'species=',f5.1, 3x, 'lambda=', f8.3, 3x, 'EP=', f6.3, + . 3x, 'log(gf)=', f7.3) +1004 format ('NO ABUNDANCE CONVERGENCE IN 30 TRIES; I QUIT!') +1005 format ('MORE THAN 1000 LINES FED TO ABPOP; I QUIT') +1013 format (i1) +1014 format (i2) + end diff --git a/Abunplot.f b/Abunplot.f new file mode 100755 index 0000000..e305bc7 --- /dev/null +++ b/Abunplot.f @@ -0,0 +1,273 @@ + + subroutine abunplot +c****************************************************************************** +c This routine produces MONGO plots of line abundances versus +c excitation potentials and equivalent widths +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Dummy.com' + real*4 ep(2500),abb(2500),logrw(2500),wavepl(2500) + equivalence (ep,dummy3(1)),(abb,dummy3(1251)),(logrw,dummy3(2501)) + real*4 style(1),ymed + character ion*4 + + +c*****dump the data into working arrays + j = 0 + do l=lim1obs,lim2obs + if (abundout(l) .ne. 999.99) then + j = j + 1 + ep(j) = e(l,1) + abb(j) = abundout(l) +c logrw(j) = dlog10(wid1comp(l)/wave1(l)) + logrw(j) = dlog10(width(l)/wave1(l)) + wavepl(j) = wave1(l) + endif + enddo + + +c*****find the plot boundaries for the excitation potential plot + xlo = 20. + do j=1,kount + xlo = amin1(xlo,ep(j)) + enddo + xhi = 0. + do j=1,kount + xhi = amax1(xhi,ep(j)) + enddo + if (xhi-xlo .lt. 5.) then + xlo = amax1((xlo+xhi)/2.-2.5,-0.2) + xhi = xlo + 5.0 + else + xlo = amax1((xlo+xhi)/2.-5.0,-0.2) + xhi = xlo + 10. + endif + ylo = 20. + do j=1,kount + ylo = amin1(ylo,abb(j)) + enddo + yhi = -20. + do j=1,kount + yhi = amax1(yhi,abb(j)) + enddo + if (yhi-ylo .lt. 0.5) then + ylo = (ylo+yhi)/2. - 0.30 + yhi = ylo + 0.60 + elseif (yhi-ylo .lt. 1.0) then + ylo = (ylo+yhi)/2. - 0.55 + yhi = ylo + 1.10 + else + ylo = (ylo+yhi)/2. - 1.10 + yhi = ylo + 2.20 + endif + + +c*****start the excitation potential plot via plot setup calls + call sm_defvar ('y_gutter','0.9') + call sm_window (1,3,1,3,1,3) + call sm_limits (xlo,xhi,ylo,yhi) + call findtic (xlo,xhi,bigxtic,smlxtic) + call findtic (ylo,yhi,bigytic,smlytic) + call sm_ticksize (smlxtic,bigxtic,smlytic,bigytic) + + +c*****draw and label the box for the excitation potential plot + call defcolor (1) + call sm_lweight (4.0) + call sm_expand (1.2) + call sm_box (0,0,0,0) + call sm_lweight (2.0) + call sm_expand (0.8) + call sm_box (1,2,4,4) + array = 'E. P. (eV)' + call sm_relocate (0.5*(xlo+xhi),ylo-0.20*(yhi-ylo)) + call sm_putlabel (5,array) + array = 'log eps' + call sm_relocate (xlo-0.10*(xhi-xlo),0.5*(yhi+ylo)) + call sm_angle (90.) + call sm_putlabel (5,array) + call sm_angle (0.) + + +c*****make the excitation potential plot + call defcolor (2) + call sm_expand (2.2) + style(1) = 43.5 + call sm_ptype (style,1) + call sm_points (ep,abb,kount) + call defcolor (4) + ymed = average + call sm_lweight (4.0) + call sm_ltype (2) + call sm_relocate (xlo,ymed) + call sm_draw (xhi,ymed) + if (kount .gt. 2 .and. deltaep .gt. 1.5) then + call sm_ltype (3) + call defcolor (3) + call sm_relocate (xlo,real(xxm1*xlo+xxb1)) + call sm_draw (xhi,real(xxm1*xhi+xxb1)) + endif + call sm_ltype (0) + call sm_lweight (2.0) + call defcolor (1) + call sm_relocate (xlo+0.05*(xhi-xlo),ylo+0.15*(yhi-ylo)) + call sm_expand (0.8) + ich = idint(charge(lim1obs) + 0.1) + if (ich .eq. 1) then + ion = ' I ' + elseif (ich .eq. 2) then + ion = ' II ' + elseif (ich .eq. 3) then + ion = ' III' + endif + iatom = idint(atom1(lim1obs)) + write (array,1002) names(iatom),ion + call sm_relocate ((xhi+xlo)/2.,yhi-0.12*(yhi-ylo)) + call sm_expand (0.8) + call sm_putlabel (5,array) + + +c*****define the plot limits for the equivalent width plot + xlo = 5000. + do j=1,kount + xlo = amin1(xlo,logrw(j)) + enddo + xhi = -5000. + do j=1,kount + xhi = amax1(xhi,logrw(j)) + enddo + xlo = int((xlo-0.01)*2.-1.)/2. + xhi = int((xhi+0.01)*2.)/2. + call sm_defvar ('y_gutter','0.9') + call sm_window (1,3,1,2,1,2) + call sm_limits (xlo,xhi,ylo,yhi) + call findtic (xlo,xhi,bigxtic,smlxtic) + call findtic (ylo,yhi,bigytic,smlytic) + call sm_ticksize (smlxtic,bigxtic,smlytic,bigytic) + + +c*****draw and label the box for the equivalent width plot + call defcolor (1) + call sm_lweight (4.0) + call sm_expand (1.2) + call sm_box (0,0,0,0) + call sm_lweight (2.0) + call sm_expand (0.8) + call sm_box (1,2,4,4) + array = 'log (EW/lambda)' + call sm_relocate (0.5*(xlo+xhi),ylo-0.20*(yhi-ylo)) + call sm_putlabel (5,array) + array = 'log eps' + call sm_relocate (xlo-0.10*(xhi-xlo),0.5*(yhi+ylo)) + call sm_angle (90.) + call sm_putlabel (5,array) + call sm_angle (0.) + + +c*****make the equivalent width plot + call defcolor (2) + call sm_expand (2.2) + style(1) = 43.5 + call sm_ptype (style,1) + call sm_points (logrw,abb,kount) + call defcolor (4) + call sm_lweight (4.0) + call sm_ltype (2) + call sm_relocate (xlo,ymed) + call sm_draw (xhi,ymed) + if (kount .gt. 2 .and. deltarw .gt. 0.5) then + call sm_ltype (3) + call defcolor (3) + call sm_relocate (xlo,real(xxm2*xlo+xxb2)) + call sm_draw (xhi,real(xxm2*xhi+xxb2)) + endif + call sm_ltype (0) + call sm_lweight (2.0) + call defcolor (1) + call sm_expand (0.8) + call sm_relocate ((xhi+xlo)/2.,yhi-0.12*(yhi-ylo)) + call sm_putlabel (5,moditle(1:56)) + call sm_relocate ((xhi+xlo)/2.,ylo+0.12*(yhi-ylo)) + call sm_putlabel (5,moditle(57:80)) + + +c*****define the plot limits for the wavelength plot + xlo = 5000000. + do j=1,kount + xlo = amin1(xlo,wavepl(j)) + enddo + xhi = 0. + do j=1,kount + xhi = amax1(xhi,wavepl(j)) + enddo + xlo = int(xlo-50.) + xhi = int(xhi+50.) + call sm_defvar ('y_gutter','0.9') + call sm_window (1,3,1,1,1,1) + call sm_limits (xlo,xhi,ylo,yhi) + call findtic (xlo,xhi,bigxtic,smlxtic) + call findtic (ylo,yhi,bigytic,smlytic) + call sm_ticksize (smlxtic,bigxtic,smlytic,bigytic) + + +c*****draw and label the box for the wavelength plot + call defcolor (1) + call sm_lweight (4.0) + call sm_expand (1.2) + call sm_box (0,0,0,0) + call sm_lweight (2.0) + call sm_expand (0.8) + call sm_box (1,2,4,4) + array = 'lambda (A)' + call sm_relocate (0.5*(xlo+xhi),ylo-0.20*(yhi-ylo)) + call sm_putlabel (5,array) + array = 'log eps' + call sm_relocate (xlo-0.10*(xhi-xlo),0.5*(yhi+ylo)) + call sm_angle (90.) + call sm_putlabel (5,array) + call sm_angle (0.) + + +c*****make the wavelength plot, and exit normally + call defcolor (2) + call sm_expand (2.2) + style(1) = 43.5 + call sm_ptype (style,1) + call sm_points (wavepl,abb,kount) + call defcolor (4) + call sm_relocate (xlo,ymed) + call sm_lweight (4.0) + call sm_ltype (2) + call sm_draw (xhi,ymed) + if (kount .gt. 2 .and. deltawv .gt. 500.) then + call sm_ltype (3) + call defcolor (3) + call sm_relocate (xlo,real(xxm3*xlo+xxb3)) + call sm_draw (xhi,real(xxm3*xhi+xxb3)) + endif + call sm_ltype (0) + call sm_lweight (2.0) + call defcolor (1) + call sm_relocate ((xhi+xlo)/2.,yhi-0.12*(yhi-ylo)) + call sm_expand (0.8) + call sm_putlabel (5,linitle) + return + + +c*****format statements +1002 format (a2,a4) + + + end + + + + + + + + diff --git a/Atmos.com b/Atmos.com new file mode 100755 index 0000000..86ac940 --- /dev/null +++ b/Atmos.com @@ -0,0 +1,62 @@ + +c****************************************************************************** +c these common blocks mainly have quantities related to the model +c atmosphere and input/output file names/numbers, and program control +c****************************************************************************** + + real*8 t(100), theta(100), tkev(100), tlog(100), + . pgas(100), ne(100), nhtot(100), numdens(8,2,100), + . molweight(100), vturb(100), scont(100), + . kapref(100), kaplam(100), tauref(100), taulam(100), + . kaplamabs(100), kaplamsca(100), + . rho(100), rhox(100), xref(100), xdepth(100) + real*8 elem(95), xabund(95), xabu(95), u(95,4,100) + real*8 flux, fudge, wavref, abscale, deltaabund + integer ntau, jtau5, iunits, itru, iraf, modelnum + integer nfparam, nfmodel, nflines, nfslines, nfobs, nftable + integer nf1out, nf2out, nf3out, nf4out, nf5out, nf6out, + . nf7out, nf8out, nf9out, nf10out, + . nfbarklem, nfbarklemUV + integer modprintopt, linprintopt, linprintalt, + . fluxintopt, plotopt, dampingopt, specfileopt, + . linfileopt, printstrong, linecount, oldcount, + . scatopt + character*80 f1out, f2out, f3out, f4out, f5out, f6out, + . f7out, f8out, f9out, f10out, + . fparam, fmodel, flines, fslines, fobs, ftable, + . fbarklem, fbarklemUV + character*60 moogpath + character*2 names(95) + character*10 modtype + character*7 control + character*3 machine + character*1 silent + + common/atmos/t, theta, tkev, tlog, + . pgas, ne, nhtot, numdens, + . molweight, vturb, scont, + . kapref, kaplam, tauref, taulam, + . kaplamabs, kaplamsca, + . rho, rhox, xref, xdepth, + . elem, xabund, xabu, u, + . flux, fudge, wavref, abscale, deltaabund, + . ntau, jtau5, iunits, itru, iraf, modelnum, + . nfparam, nfmodel, nflines, nfslines, nfobs, nftable, + . nf1out, nf2out, nf3out, nf4out, nf5out, nf6out, + . nf7out, nf8out, nf9out, nf10out, + . nfbarklem, nfbarklemUV, + . modprintopt, linprintopt, linprintalt, + . fluxintopt, plotopt, dampingopt, specfileopt, + . linfileopt, printstrong, linecount, oldcount, scatopt + + common/charstuff/ f1out, f2out, f3out, f4out, f5out, f6out, + . f7out, f8out, f9out, f10out, + . fparam, fmodel, flines, fslines, fobs, ftable, + . fbarklem, fbarklemUV, + . moogpath, + . names, + . modtype, + . control, + . machine, + . silent + diff --git a/Barklem.dat b/Barklem.dat new file mode 100755 index 0000000..20eb14f --- /dev/null +++ b/Barklem.dat @@ -0,0 +1,15935 @@ + 3000.062 26.1 -7.888 0.240 3.91E+08 + 3000.242 26.1 -7.476 0.283 1.05E+09 + 3000.291 26.1 -7.511 0.284 1.18E+08 + 3000.384 26.1 -7.430 0.225 8.16E+08 + 3000.543 27.0 -7.655 0.284 1.10E+08 + 3000.863 20.0 -7.355 0.306 1.58E+08 + 3000.866 22.0 -7.484 0.278 3.26E+07 + 3000.882 24.0 -7.562 0.284 1.64E+08 + 3000.948 26.0 -7.695 0.264 2.02E+08 + 3001.132 26.1 -7.440 0.221 9.08E+08 + 3001.401 26.1 -7.435 0.227 8.08E+08 + 3001.595 26.1 -7.441 0.221 8.97E+08 + 3001.971 26.1 -7.445 0.224 9.20E+08 + 3002.321 26.1 -7.791 0.197 3.19E+08 + 3002.417 26.1 -7.931 0.212 4.31E+08 + 3002.450 26.1 -7.914 0.382 4.66E+08 + 3002.485 28.0 -7.756 0.246 1.40E+08 + 3002.641 26.1 -7.425 0.233 8.89E+08 + 3002.646 26.1 -7.776 0.206 3.16E+08 + 3003.101 26.1 -7.931 0.212 4.31E+08 + 3003.406 26.1 -7.581 0.291 1.13E+09 + 3003.621 28.0 -7.747 0.246 1.18E+08 + 3003.889 26.1 -7.434 0.224 7.93E+08 + 3004.257 26.1 -7.888 0.238 3.93E+08 + 3004.436 26.1 -7.395 0.278 1.04E+09 + 3004.974 26.1 -7.562 0.286 1.06E+09 + 3005.058 24.0 -7.558 0.285 1.78E+08 + 3005.376 26.1 -7.931 0.201 5.02E+08 + 3005.492 26.1 -7.554 0.287 1.11E+09 + 3005.648 26.1 -7.543 0.284 1.17E+08 + 3006.110 26.1 -7.539 0.277 1.11E+09 + 3006.242 26.1 -7.931 0.201 5.02E+08 + 3006.858 26.1 -7.580 0.288 1.11E+09 + 3006.861 20.0 -7.353 0.306 1.60E+08 + 3007.078 26.1 -7.505 0.289 1.00E+09 + 3007.282 26.0 -7.663 0.272 6.47E+06 + 3007.586 26.1 -7.933 0.198 5.67E+08 + 3007.650 25.0 -7.589 0.240 1.16E+08 + 3007.760 26.1 -7.501 0.282 1.03E+09 + 3007.945 26.1 -7.437 0.223 7.40E+08 + 3007.948 26.1 -7.440 0.229 7.40E+08 + 3008.140 26.0 -7.694 0.264 2.04E+08 + 3008.375 26.1 -7.593 0.332 2.22E+08 + 3009.093 26.0 -7.637 0.246 1.19E+08 + 3009.148 26.1 -7.890 0.267 4.04E+08 + 3009.206 20.0 -7.355 0.306 1.59E+08 + 3009.267 26.1 -7.439 0.227 7.49E+08 + 3009.463 26.1 -7.678 0.373 7.32E+08 + 3009.569 26.0 -7.507 0.296 5.99E+08 + 3009.601 26.1 -7.680 0.217 4.00E+08 + 3009.880 26.1 -7.683 0.221 4.00E+08 + 3010.138 26.1 -7.443 0.222 9.30E+08 + 3010.216 26.1 -7.419 0.233 7.14E+08 + 3010.225 26.1 -7.531 0.293 9.64E+08 + 3010.462 26.1 -7.890 0.267 4.04E+08 + 3010.638 26.1 -7.892 0.216 3.29E+08 + 3010.832 26.1 -7.439 0.227 1.00E+09 + 3011.163 25.0 -7.590 0.240 1.12E+08 + 3011.341 26.1 -7.933 0.198 5.67E+08 + 3011.372 25.0 -7.590 0.240 1.12E+08 + 3011.482 26.0 -7.788 0.255 5.81E+07 + 3011.502 26.1 -7.932 0.206 5.03E+08 + 3011.539 26.1 -7.435 0.216 9.05E+08 + 3011.541 26.1 -7.519 0.265 9.05E+08 + 3011.859 26.1 -7.552 0.283 1.03E+09 + 3012.001 28.0 -7.713 0.250 2.13E+08 + 3012.113 26.1 -7.550 0.283 9.34E+08 + 3012.210 26.1 -7.933 0.198 5.67E+08 + 3012.595 26.1 -7.889 0.238 3.99E+08 + 3013.379 26.1 -7.505 0.289 4.17E+08 + 3013.589 27.0 -7.675 0.281 1.39E+08 + 3013.608 26.1 -7.478 0.282 1.12E+09 + 3013.673 26.1 -7.553 0.289 1.02E+09 + 3013.699 24.0 -7.572 0.281 1.80E+08 + 3013.796 26.1 -7.892 0.217 3.29E+08 + 3014.255 26.1 -7.445 0.225 9.19E+08 + 3014.579 26.1 -7.873 0.213 7.29E+08 + 3014.747 26.1 -7.492 0.283 5.45E+08 + 3014.959 26.1 -7.541 0.282 1.10E+09 + 3015.003 26.1 -7.440 0.226 7.42E+08 + 3015.196 24.0 -7.574 0.280 4.06E+08 + 3015.368 21.0 -7.542 0.251 1.68E+08 + 3015.378 26.1 -7.554 0.290 9.80E+08 + 3015.557 26.1 -7.434 0.225 7.77E+08 + 3015.635 16.0 -7.432 0.257 8.60E+08 + 3015.796 26.1 -7.534 0.284 1.14E+09 + 3015.854 26.1 -7.393 0.283 9.43E+08 + 3015.913 26.1 -7.873 0.213 7.29E+08 + 3015.921 26.0 -7.634 0.247 1.19E+08 + 3016.182 26.0 -7.491 0.294 5.99E+08 + 3016.453 25.0 -7.590 0.239 1.06E+08 + 3016.539 26.1 -7.531 0.293 9.55E+08 + 3016.885 26.1 -7.563 0.285 1.11E+09 + 3016.934 26.1 -7.678 0.373 6.26E+08 + 3017.257 26.1 -7.559 0.288 5.07E+08 + 3017.316 26.1 -7.593 0.332 2.23E+08 + 3017.542 27.0 -7.659 0.282 1.59E+08 + 3017.627 26.0 -7.695 0.264 2.02E+08 + 3018.136 26.0 -7.638 0.246 1.69E+08 + 3018.213 26.1 -7.894 0.225 3.32E+08 + 3018.566 26.1 -7.520 0.293 1.00E+09 + 3018.678 26.1 -7.873 0.213 7.29E+08 + 3018.983 26.0 -7.500 0.295 6.01E+08 + 3019.118 26.1 -7.549 0.288 1.01E+09 + 3019.143 28.0 -7.781 0.252 1.20E+08 + 3019.223 26.1 -7.439 0.225 1.01E+09 + 3019.299 26.1 -7.792 0.198 3.19E+08 + 3019.351 21.0 -7.539 0.251 1.64E+08 + 3019.384 26.1 -7.435 0.222 7.79E+08 + 3019.467 26.1 -7.933 0.193 6.08E+08 + 3019.798 26.1 -7.778 0.216 2.91E+08 + 3019.861 26.1 -7.395 0.279 1.04E+09 + 3020.009 26.1 -7.893 0.238 4.00E+08 + 3020.262 26.1 -7.932 0.206 5.04E+08 + 3020.330 26.1 -7.435 0.223 7.79E+08 + 3020.495 26.0 -7.699 0.263 1.97E+08 + 3020.643 26.0 -7.711 0.259 1.97E+08 + 3020.666 24.0 -7.574 0.280 4.06E+08 + 3021.073 26.0 -7.704 0.261 1.99E+08 + 3021.162 26.1 -7.539 0.289 1.02E+09 + 3021.386 26.1 -7.894 0.227 3.32E+08 + 3021.417 26.1 -7.894 0.211 3.07E+08 + 3021.556 24.0 -7.562 0.283 3.92E+08 + 3021.595 26.1 -7.923 0.249 5.40E+08 + 3021.619 26.1 -7.427 0.231 8.74E+08 + 3021.663 26.1 -7.923 0.249 6.36E+08 + 3021.743 26.1 -7.475 0.349 3.04E+08 + 3021.930 26.1 -7.436 0.224 8.09E+08 + 3021.969 26.1 -7.538 0.282 1.03E+09 + 3022.278 26.1 -7.560 0.286 9.85E+08 + 3023.251 26.1 -7.933 0.193 6.08E+08 + 3023.441 26.1 -7.559 0.288 5.20E+08 + 3023.726 26.1 -7.505 0.288 9.98E+08 + 3023.834 26.1 -7.892 0.233 2.94E+08 + 3024.033 26.0 -7.663 0.272 6.47E+06 + 3024.334 24.0 -7.572 0.280 1.80E+08 + 3024.609 26.1 -7.488 0.280 4.93E+08 + 3024.708 26.1 -7.678 0.373 6.26E+08 + 3025.536 26.1 -7.679 0.218 4.00E+08 + 3025.618 26.1 -7.557 0.288 1.87E+08 + 3025.843 26.0 -7.695 0.264 2.02E+08 + 3025.986 26.1 -7.891 0.232 2.94E+08 + 3026.461 26.0 -7.494 0.294 5.98E+08 + 3026.747 26.1 -7.560 0.295 1.06E+09 + 3026.907 26.1 -7.531 0.292 9.59E+08 + 3026.934 26.1 -7.565 0.285 5.87E+08 + 3027.155 26.1 -7.441 0.280 9.35E+08 + 3027.380 26.1 -7.784 0.202 3.62E+08 + 3027.490 26.1 -7.888 0.275 4.72E+08 + 3027.637 26.1 -7.554 0.292 9.53E+08 + 3027.953 26.1 -7.435 0.223 7.76E+08 + 3027.960 26.1 -7.472 0.284 1.08E+09 + 3028.225 26.1 -7.576 0.285 1.23E+09 + 3028.262 26.1 -7.435 0.225 8.11E+08 + 3028.877 26.1 -7.538 0.289 1.10E+09 + 3029.160 24.0 -7.573 0.279 1.90E+08 + 3029.192 26.1 -7.557 0.289 1.05E+09 + 3029.204 26.1 -7.935 0.224 1.05E+09 + 3029.569 26.1 -7.771 0.188 2.86E+08 + 3029.691 26.1 -7.894 0.230 3.35E+08 + 3030.100 26.1 -7.540 0.290 1.00E+09 + 3030.243 24.0 -7.570 0.280 4.01E+08 + 3030.323 26.1 -7.427 0.223 7.95E+08 + 3030.606 26.1 -7.561 0.285 1.01E+09 + 3030.757 21.0 -7.542 0.250 1.68E+08 + 3030.764 26.1 -7.475 0.349 3.05E+08 + 3030.871 26.1 -7.434 0.222 7.76E+08 + 3031.066 26.1 -7.535 0.286 9.67E+08 + 3031.351 24.0 -7.574 0.279 4.06E+08 + 3031.568 26.1 -7.575 0.289 1.23E+09 + 3031.627 26.1 -7.931 0.217 4.27E+08 + 3031.634 26.0 -7.491 0.293 5.99E+08 + 3031.867 28.0 -7.782 0.252 6.44E+07 + 3032.096 26.1 -7.520 0.282 1.07E+09 + 3032.161 26.1 -7.502 0.282 1.08E+09 + 3033.444 26.1 -7.416 0.235 7.14E+08 + 3033.563 26.1 -7.932 0.206 5.04E+08 + 3033.575 26.1 -7.431 0.223 8.77E+08 + 3033.589 26.1 -7.474 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2975.481 24.0 -7.562 0.286 1.64E+08 + 2975.937 26.1 -7.889 0.223 3.43E+08 + 2976.177 26.1 -7.725 0.304 4.66E+08 + 2976.290 26.1 -7.551 0.288 1.00E+09 + 2976.395 26.1 -7.894 0.231 3.35E+08 + 2976.718 26.1 -7.374 0.293 1.10E+09 + 2977.193 26.1 -7.518 0.289 1.03E+09 + 2978.370 26.1 -7.432 0.231 8.97E+08 + 2978.812 26.1 -7.732 0.320 4.15E+08 + 2978.826 26.1 -7.438 0.228 8.44E+08 + 2978.846 26.1 -7.889 0.237 3.99E+08 + 2978.899 26.1 -7.576 0.287 1.15E+09 + 2979.081 26.1 -7.887 0.247 4.10E+08 + 2979.114 26.1 -7.785 0.207 3.63E+08 + 2979.163 26.1 -7.551 0.285 9.80E+08 + 2979.354 26.1 -7.888 0.221 3.44E+08 + 2979.384 26.1 -7.436 0.225 7.40E+08 + 2980.011 26.1 -7.785 0.239 4.27E+08 + 2980.451 26.1 -7.727 0.307 4.27E+08 + 2980.534 26.0 -7.786 0.255 1.14E+08 + 2980.628 26.1 -7.742 0.231 4.03E+08 + 2980.759 21.0 -7.528 0.254 1.55E+08 + 2980.788 24.0 -7.565 0.285 1.55E+08 + 2980.896 26.1 -7.432 0.223 7.75E+08 + 2980.963 26.1 -7.893 0.211 2.92E+08 + 2981.445 26.0 -7.663 0.273 6.47E+06 + 2981.468 22.0 -7.484 0.280 3.26E+07 + 2981.646 28.0 -7.744 0.246 1.82E+08 + 2982.059 26.1 -7.874 0.280 4.15E+08 + 2982.258 26.1 -7.887 0.223 3.02E+08 + 2982.273 26.1 -7.437 0.229 8.70E+08 + 2982.482 26.1 -7.430 0.233 8.16E+08 + 2982.945 26.1 -7.927 0.298 4.56E+08 + 2983.010 26.1 -7.422 0.218 7.45E+08 + 2983.314 22.0 -7.484 0.279 3.43E+07 + 2983.570 26.0 -7.704 0.261 1.99E+08 + 2983.718 26.1 -7.742 0.230 4.03E+08 + 2984.067 26.1 -7.556 0.285 1.07E+09 + 2984.131 28.0 -7.776 0.253 1.40E+08 + 2984.186 26.1 -7.576 0.291 1.12E+09 + 2984.270 26.1 -7.873 0.284 4.26E+08 + 2984.288 26.1 -7.502 0.284 9.19E+08 + 2984.825 26.1 -7.777 0.208 3.16E+08 + 2984.889 26.1 -7.896 0.240 3.81E+08 + 2984.961 26.1 -7.435 0.227 8.38E+08 + 2985.290 26.1 -7.511 0.284 1.18E+08 + 2985.293 26.1 -7.888 0.233 3.92E+08 + 2985.519 26.1 -7.896 0.210 3.16E+08 + 2985.545 26.1 -7.775 0.200 3.16E+08 + 2985.640 26.1 -7.440 0.227 7.43E+08 + 2985.876 26.1 -7.435 0.230 8.14E+08 + 2986.345 26.1 -7.430 0.229 8.41E+08 + 2986.456 26.0 -7.655 0.273 4.88E+06 + 2986.611 26.1 -7.892 0.227 2.95E+08 + 2986.654 26.0 -7.630 0.247 1.08E+08 + 2986.912 26.1 -7.877 0.274 3.62E+08 + 2987.158 27.0 -7.669 0.283 1.26E+08 + 2987.194 26.1 -7.440 0.227 8.40E+08 + 2987.270 26.1 -7.877 0.274 3.62E+08 + 2987.290 26.0 -7.500 0.297 6.01E+08 + 2987.537 26.1 -7.578 0.289 9.08E+08 + 2987.552 26.1 -7.439 0.226 9.08E+08 + 2987.643 14.0 -7.383 0.246 3.33E+08 + 2987.789 26.1 -7.429 0.212 9.08E+08 + 2987.836 26.1 -7.505 0.283 1.07E+09 + 2987.840 26.1 -7.436 0.221 7.67E+08 + 2988.065 26.1 -7.580 0.292 1.12E+09 + 2988.131 26.1 -7.736 0.333 3.91E+08 + 2988.404 26.1 -7.442 0.229 8.14E+08 + 2988.618 26.1 -7.896 0.210 1.54E+08 + 2988.648 24.0 -7.558 0.250 1.66E+08 + 2988.712 26.1 -7.511 0.289 1.14E+09 + 2988.945 26.1 -7.533 0.287 9.88E+08 + 2988.954 26.1 -7.444 0.224 9.09E+08 + 2988.974 21.0 -7.530 0.253 1.56E+08 + 2989.011 26.1 -7.877 0.275 3.62E+08 + 2989.054 26.1 -7.536 0.286 9.88E+08 + 2989.064 26.1 -7.437 0.224 7.42E+08 + 2989.376 26.1 -7.876 0.276 3.77E+08 + 2989.584 27.0 -7.670 0.283 1.38E+08 + 2989.734 26.1 -7.876 0.276 3.77E+08 + 2989.822 26.1 -7.579 0.289 1.15E+09 + 2989.917 26.1 -7.436 0.224 7.40E+08 + 2990.219 26.1 -7.435 0.229 6.62E+08 + 2990.391 26.0 -7.789 0.255 1.02E+08 + 2991.079 26.1 -7.898 0.216 1.44E+08 + 2991.118 28.0 -7.745 0.256 7.12E+07 + 2991.228 26.1 -7.893 0.225 3.51E+08 + 2991.818 26.1 -7.444 0.230 8.16E+08 + 2991.820 26.1 -7.538 0.295 8.16E+08 + 2991.887 24.0 -7.566 0.284 1.51E+08 + 2992.592 28.0 -7.755 0.246 1.44E+08 + 2992.642 26.1 -7.511 0.284 1.18E+08 + 2993.115 26.1 -7.783 0.194 3.63E+08 + 2993.201 26.1 -7.735 0.332 3.91E+08 + 2993.357 26.1 -7.874 0.279 4.15E+08 + 2993.371 26.1 -7.435 0.227 8.44E+08 + 2993.474 26.1 -7.443 0.223 8.87E+08 + 2993.581 26.1 -7.735 0.333 9.80E+08 + 2993.584 26.1 -7.532 0.284 9.80E+08 + 2993.671 26.1 -7.557 0.294 1.07E+09 + 2994.053 24.0 -7.559 0.250 1.80E+08 + 2994.153 26.1 -7.440 0.229 8.68E+08 + 2994.421 26.1 -7.729 0.319 4.15E+08 + 2994.427 26.0 -7.699 0.263 1.97E+08 + 2994.453 28.0 -7.755 0.246 1.63E+07 + 2994.502 26.0 -7.655 0.273 4.88E+06 + 2994.957 20.0 -7.354 0.306 1.59E+08 + 2995.100 24.0 -7.559 0.250 4.04E+08 + 2995.726 26.1 -7.511 0.289 1.10E+09 + 2996.120 26.1 -7.550 0.287 1.00E+09 + 2996.385 26.0 -7.634 0.247 1.86E+08 + 2996.575 24.0 -7.565 0.284 1.55E+08 + 2997.300 26.1 -7.872 0.289 4.42E+08 + 2997.316 20.0 -7.353 0.306 1.60E+08 + 2997.381 26.1 -7.395 0.282 1.08E+09 + 2997.430 26.1 -7.463 0.284 1.03E+09 + 2997.523 26.1 -7.501 0.281 1.02E+09 + 2997.971 26.1 -7.543 0.283 1.17E+08 + 2998.782 24.0 -7.560 0.250 1.90E+08 + 2998.849 26.1 -7.535 0.293 3.75E+08 + 2998.852 26.1 -7.895 0.233 3.75E+08 + 2998.911 26.1 -7.437 0.222 7.66E+08 + 2999.512 26.0 -7.517 0.298 6.05E+08 + 2999.596 26.1 -7.572 0.282 1.18E+09 + 2999.645 20.0 -7.354 0.306 1.59E+08 + 2999.730 26.1 -7.930 0.212 3.74E+08 + 2999.759 26.1 -7.495 0.285 6.35E+08 @@ -0,0 +1,625 @@ + + block data atomic +c****************************************************************************** +c this routine contains atomic data ordered by atomic number +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Quants.com' +c +c This routine contains the basic atomic data +c +c names = atomic symbols for the elements + data names/'H ','He','Li','Be','B ','C ','N ','O ','F ','Ne', + . 'Na','Mg','Al','Si','P ','S ','Cl','Ar','K ','Ca', + . 'Sc','Ti','V ','Cr','Mn','Fe','Co','Ni','Cu','Zn', + . 'Ga','Ge','As','Se','Br','Kr','Rb','Sr','Y ','Zr', + . 'Nb','Mo','Tc','Ru','Rh','Pd','Ag','Cd','In','Sn', + . 'Sb','Te','I ','Xe','Cs','Ba','La','Ce','Pr','Nd', + . 'Pm','Sm','Eu','Gd','Tb','Dy','Ho','Er','Tm','Yb', + . 'Lu','Hf','Ta','Wl','Re','Os','Ir','Pt','Au','Hg', + . 'Tl','Pb','Bi','Po','At','Rn','Fr','Ra','Ac','Th', + . 'Pa','U ','Np','Pu','Am'/ +c +c xabu = the set of current solar (when available) or meteorite +c abundances, scaled to log(h) = 12.00 . The data are from Asplund +c et al. (2009, Ann. Rev. Ast. Ap., 47, 481). + data xsolar/ + * 12.00,10.93, 1.05, 1.38, 2.70, 8.43, 7.83, 8.69, 4.56, 7.93, + 1 6.24, 7.60, 6.45, 7.51, 5.41, 7.12, 5.50, 6.40, 5.03, 6.34, + 2 3.15, 4.95, 3.93, 5.64, 5.43, 7.50, 4.99, 6.22, 4.19, 4.56, + 3 3.04, 3.65, 2.30, 3.34, 2.54, 3.25, 2.52, 2.87, 2.21, 2.58, + 4 1.46, 1.88,-5.00, 1.75, 0.91, 1.57, 0.94, 1.71, 0.80, 2.04, + 5 1.01, 2.18, 1.55, 2.24, 1.08, 2.18, 1.10, 1.58, 0.72, 1.42, + 6 -5.00, 0.96, 0.52, 1.07, 0.30, 1.10, 0.48, 0.92, 0.10, 0.84, + 7 0.10, 0.85,-0.12, 0.85, 0.26, 1.40, 1.38, 1.62, 0.92, 1.17, + 8 0.90, 1.75, 0.65,-5.00,-5.00,-5.00,-5.00,-5.00,-5.00, 0.02, + 9 -5.00,-0.54,-5.00,-5.00,-5.00/ +c +c xam = atomic mass (amu) + data xam/ + * 1.008,4.003,6.941,9.012,10.81,12.01,14.01,16.00,19.00,20.18, + 1 22.99,24.31,26.98,28.08,30.97,32.06,35.45,39.95,39.10,40.08, + 2 44.96,47.90,50.94,52.00,54.94,55.85,58.93,58.71,63.55,65.37, + 3 69.72,72.59,74.92,78.96,79.90,83.80,85.47,87.62,88.91,91.22, + 4 92.91,95.94,98.91,101.1,102.9,106.4,107.9,112.4,114.8,118.7, + 5 121.8,127.6,126.9,131.3,132.9,137.3,138.9,140.1,140.9,144.2, + 6 145.0,150.4,152.0,157.3,158.9,162.5,164.9,167.3,168.9,173.0, + 7 175.0,178.5,181.0,183.9,186.2,190.2,192.2,195.1,197.0,200.6, + 8 204.4,207.2,209.0,210.0,210.0,222.0,223.0,226.0,227.0,232.0, + 9 231.0,238.0,237.0,244.0,243.0/ +c +c xchi1 = first ionization potential (ev) +c data are mainly from I. S. Grigoriev & E. Z. Meilikhov 1997, Handbook of +c Physical Quantities, CRC Press, Boca Raton, 516; supplemented +c by the CRC, 1994 edition; updated from the NIST web site Dec. 2, 2000; +c just for xchi1 I take the values from the NIST web site, which +c essentially agree with the CRC values + data xchi1/ + * 13.60,24.59,5.392,9.323,8.298,11.26,14.53,13.62,17.42,21.56, + 1 5.139,7.646,5.986,8.152,10.49,10.36,12.97,15.76,4.340,6.113, + 2 6.562,6.828,6.746,6.766,7.434,7.902,7.881,7.640,7.726,9.394, + 3 5.999,7.899,9.789,9.752,11.81,14.00,4.177,5.695,6.217,6.634, + 4 6.579,7.092, 7.28,7.361,7.459,8.337,7.576,8.994,5.786,7.344, + 5 8.608,9.010,10.45,12.13,3.894,5.212,5.577,5.539,5.473,5.525, + 6 5.582,5.644,5.670,6.150,5.864,5.939,6.022,6.108,6.184,6.254, + 7 5.426,6.825,7.550,7.864,7.834,8.438,8.967,8.959,9.226,10.44, + 8 6.108,7.417,7.286,8.414, 9.0,10.75,4.073,5.278, 5.17,6.307, + 9 5.89,6.194,6.266,6.026,5.974/ +c +c xchi2 = second ionization potential (ev) +c a value of 30 in the chi data denotes an unknown value + data xchi2/ + * 50.00,54.42,75.64,18.21,25.16,24.38,29.60,35.12,34.97,40.96, + * 47.29,15.04,18.83,16.35,19.77,23.34,23.81,27.63,31.63,11.87, + * 12.80,13.58,14.66,16.50,15.64,16.19,17.08,18.17,20.29,17.96, + * 20.52,15.94,18.59,21.16,21.81,24.36,27.29,11.03,12.22,13.13, + * 14.32,16.16,15.26,16.76,18.08,19.43,21.49,16.91,18.87,14.63, + * 16.53, 18.6,19.13,20.98,23.16,10.00, 11.1, 10.8, 10.6, 10.7, + * 10.9, 11.1,11.24, 12.1, 11.5, 11.7, 11.8, 11.9, 12.1,12.18, + * 13.9, 14.9, 16.2, 17.7, 16.6, 17.0, 30.,18.56, 20.5,18.76, + * 20.43,15.03,16.70, 19.0, 30., 30., 22.0,10.15,11.75, 11.9, + * 12.0, 11.9, 30., 30., 30./ +c +c xchi3 = third ionization potential (ev) +c a value of 60 in the chi data denotes an unknown value +c a valu of 99.99 denotes a very large value + data xchi3/ + * 90.00,90.00,122.5,153.9,37.93,47.89,47.45,54.94,62.71,63.46, + * 71.62,80.14,28.45,33.49,30.20,34.83,39.61,40.91,45.81,50.91, + * 24.76,27.49,29.31, 31.0,33.67,30.65, 33.5, 35.3,36.84,39.72, + * 30.73, 34.2, 28.4,30.82, 35.9,36.95, 39.2,42.88,20.53, 23.1, + * 25.0, 27.2, 29.5, 28.5, 31.1, 32.9, 34.8,37.47, 28.0,30.50, + * 25.32,27.96, 33.0, 31.0, 33.4, 35.8,19.18,20.20,21.62, 22.1, + * 22.3, 23.4, 24.9, 20.6, 21.9, 22.8, 22.8, 22.7, 23.7,25.05, + * 20.96, 23.3, 60., 60., 60., 60., 60., 60., 34., 34.2, + * 29.85,31.94,25.56, 60., 60., 60., 60., 60., 20., 18.3, + * 60., 20., 60., 60., 60./ +c +c these partition function constants are from ATLAS9; not that those +c data do not extend to the third ion (e.g. Ag IV) for elements +c heavier than Ni, and they should be updated as needed. Here I +c simply put placeholder partition function data + data ((nudata(l,m),l=1,6),m= 1, 20)/ + * 200020001, 200020011, 201620881, 231228281, 378953411, 10, H 01 + * 100010001, 100010001, 100010001, 100010001, 100010001, 11, + * 100010001, 100010001, 100010001, 100010001, 100010001, 12, + * 100010001, 100010001, 100010001, 100010001, 100010001, 13, + * 100010001, 100010011, 102111241, 145022061, 363059451, 20, He 02 + * 200020001, 200020071, 208524971, 382669341, 128222452, 21, + * 100010001, 100010001, 100010001, 100010001, 100010001, 22, + * 100010001, 100010001, 100010001, 100010001, 100010001, 23, + * 200020011, 201220481, 212922881, 258731081, 394251691, 30, Li 03 + * 100010001, 100010201, 126225521, 67216512, 351165562, 31, + * 200020001, 200020211, 227936571, 69610342, 137217102, 32, + * 100010001, 100010001, 100010001, 100010001, 100010001, 33, + * 100010051, 104311441, 131615641, 190623681, 298037691, 40, Be 04 + * 200120231, 211422771, 249627631, 309034911, 398545051, 41, + * 100010001, 100010201, 126225521, 67216512, 351165562, 42, + * 200020001, 200020011, 201220661, 223426161, 332644691, 43, + * 600060001, 600560281, 608761991, 637466191, 693973361, 50, B 05 + * 100310831, 132016901, 214226411, 315736741, 419147071, 51, + * 200721061, 233526401, 297533311, 369040481, 440747651, 52, + * 100010001, 100010001, 100010001, 100010001, 100010001, 53/ + data ((nudata(l,m),l=1,6),m= 21, 40)/ + * 893292271, 96110042, 105311262, 126315202, 196126432, 60, C 06 + * 595060251, 620865751, 713280191, 95712292, 167623542, 61, + * 105513201, 180324851, 341851341, 88416332, 296550722, 62, + * 204922771, 262630421, 350941931, 494556971, 644872001, 63, + * 403141851, 457051681, 594071181, 92913362, 203331152, 70, N 07 + * 919899541, 107211512, 124914302, 182526232, 403762662, 71, + * 596862721, 684177081, 88110342, 128317062, 239334312, 72, + * 112816481, 240733751, 462068491, 116419932, 283736822, 73, + * 874789691, 924795711, 99410492, 115213492, 169022242, 80, O 08 + * 424151091, 622874781, 91312832, 221842502, 79914013, 81, + * 95610702, 118113032, 149619922, 329761642, 101914173, 82, + * 603567171, 775391141, 106612482, 143716252, 181420032, 83, + * 575958511, 589859231, 595860671, 636470031, 815199581, 90, F 09 + * 900296401, 102610802, 113912542, 152921152, 318348952, 91, + * 469162651, 791295541, 121419552, 402686872, 154822203, 92, + * 99511422, 129214572, 170523002, 320140922, 498458762, 93, + * 100010001, 100010051, 105313051, 210239461, 74013022, 100, Ne 10 + * 580158751, 591759741, 642687101, 159332652, 64111533, 101, + * 93510272, 110411662, 127116062, 257647882, 75110223, 102, + * 529774371, 94611322, 135816202, 188221442, 240626682, 103/ + data ((nudata(l,m),l=1,6),m= 41, 60)/ + * 200020001, 200320211, 207322131, 253031421, 417657451, 110, Na 11 + * 100010001, 100010161, 119621261, 50711872, 246445382, 111, + * 580158751, 591860351, 71813142, 321968812, 106014333, 112, + * 96910772, 116012242, 130714232, 153916552, 177118872, 113, + * 100010011, 101410621, 118414581, 204831781, 509479731, 120, Mg 12 + * 200120051, 202921001, 226926901, 368457091, 92814872, 121, + * 100010001, 100110611, 177455431, 176546012, 99718753, 122, + * 579758751, 591459501, 600560591, 611461681, 622362781, 123, + * 558857701, 583558761, 593260591, 635969541, 796790971, 130, Al 13 + * 100310211, 110313021, 172828201, 55311252, 215637942, 131, + * 200320201, 208622331, 250530971, 410251081, 611571211, 132, + * 100010001, 100210881, 207436531, 523168101, 838999681, 133, + * 825189211, 95210052, 106211532, 134317202, 237934082, 140, Si 14 + * 563057761, 588160311, 631768671, 791097651, 127817282, 141, + * 101110771, 126716471, 232438081, 71914052, 262045302, 142, + * 200720521, 217224081, 284439171, 551370951, 86810262, 143, + * 402643441, 496757481, 658274401, 833492941, 103511532, 150, P 15 + * 874497931, 106011282, 119812802, 138415142, 164717802, 151, + * 564058061, 604164611, 709579551, 90410172, 112912422, 152, + * 100811411, 149720221, 280936121, 441552181, 602168241, 153/ + data ((nudata(l,m),l=1,6),m= 61, 80)/ + * 822887891, 930697831, 102610932, 121614492, 185124742, 160, S 16 + * 443056011, 694982961, 96911522, 144218572, 227326892, 161, + * 91610392, 113512242, 136416942, 233429882, 364242962, 162, + * 560058861, 633871081, 82410062, 123314602, 168619132, 163, + * 538155931, 571657911, 598067191, 89013782, 227737172, 170, Cl 17 + * 873396771, 104411072, 118513532, 175525872, 406763932, 171, + * 506569571, 87610522, 134421682, 439092662, 182132573, 172, + * 95110872, 120013232, 154921252, 345149322, 641378942, 173, + * 100010001, 100010051, 106913911, 240147261, 90716112, 180, Ar 18 + * 550256831, 578158781, 636585461, 151530162, 58010303, 181, + * 92110362, 112412002, 133216772, 254443722, 76512833, 182, + * 582082081, 103112292, 149920212, 309750502, 720793642, 183, + * 200020011, 200720361, 211923291, 280137141, 525575741, 190, K 19 + * 100010001, 100110341, 135929551, 79119282, 405274892, 191, + * 554657081, 581260301, 73012702, 285363872, 129023363, 192, + * 96010862, 118413212, 180836632, 90321023, 416863253, 193, + * 100110061, 104311741, 145919971, 294345051, 69010322, 200, Ca 20 + * 205822781, 279234761, 427553061, 688994901, 136319772, 201, + * 100010001, 100510821, 168744821, 130232522, 69012813, 202, + * 555157161, 585662471, 82816862, 42510013, 168423663, 203/ + data ((nudata(l,m),l=1,6),m= 81,100)/ + * 924696691, 105212282, 151219062, 240530032, 368944512, 210, Sc 21 + * 190424662, 297634542, 391743752, 482952832, 573761912, 211, + * 976799291, 101110322, 105810882, 111911502, 118112122, 212, + * 100010001, 100510821, 168744821, 130232522, 69012813, 213, + * 181021172, 260333222, 430155582, 710089242, 110213293, 220, Ti 22 + * 474659872, 721284672, 98211413, 134515623, 177919963, 221, + * 228327012, 308134272, 381143862, 534563472, 734983512, 222, + * 971498311, 99210032, 102610572, 108711172, 114711782, 223, + * 272835172, 425851532, 632278322, 97212013, 146817723, 230, V 23 + * 373954132, 743597002, 121414713, 173920143, 229225713, 231, + * 323142642, 519660272, 679975352, 824789522, 96610363, 232, + * 248329302, 324234952, 373439752, 421744582, 469949412, 233, + * 717277611, 92911652, 152620872, 295141952, 550468122, 240, Cr 24 + * 71611552, 205635512, 558281952, 115315823, 205625293, 241, + * 280639822, 538369722, 87610823, 129115003, 170919183, 242, + * 377150952, 616070292, 791788382, 97610683, 116012523, 243, + * 600060321, 629270891, 86911302, 151020222, 267534752, 250, Mn 25 + * 739594821, 139921212, 309342852, 567372412, 97112553, 251, + * 98417472, 265535782, 454754842, 641973532, 828792212, 252, + * 328847052, 586668342, 771785912, 94710343, 112112093, 253/ + data ((nudata(l,m),l=1,6),m=101,120)/ + * 197023222, 274433302, 416753952, 723799822, 139419053, 260, Fe 26 + * 409453722, 686687452, 110213823, 174322233, 286437043, 261, + * 262136422, 501167232, 87911303, 138916483, 190721673, 262, + * 98723522, 420363072, 87011423, 145117913, 215925463, 263, + * 199427202, 335740022, 474957182, 708090462, 118315403, 270, Co 27 + * 279739202, 490858232, 684582472, 104713233, 159818733, 271, + * 279836622, 461857562, 720693022, 124915873, 192522633, 272, + * 262136422, 501167232, 87911303, 138916483, 190821673, 273, + * 227027622, 306233052, 356839222, 446052912, 652382292, 280, Ni 28 + * 108416342, 222428472, 353944332, 577378932, 110314303, 281, + * 198724282, 293236452, 468362702, 86511123, 136016073, 282, + * 279836622, 461857562, 720693022, 124915873, 192522633, 283, + * 201620781, 231026761, 314737361, 450555381, 692386911, 290, Cu 29 + * 109415761, 247938311, 58910042, 190937022, 68311693, 291, + * 897195961, 107212972, 165021182, 260230862, 356940532, 292, + * 100010001, 100010001, 100010001, 100010001, 100010001, 293, + * 100010001, 100410231, 108712611, 167124841, 388460411, 300, Zn 30 + * 200020021, 201620761, 223726341, 351352061, 80812472, 301, + * 100610471, 122617301, 300566361, 149924112, 332342352, 302, + * 100010001, 100010001, 100010001, 100010001, 100010001, 303/ + data ((nudata(l,m),l=1,6),m=121,140)/ + * 403245601, 493151431, 529654331, 559358091, 611065171, 310, Ga 31 + * 99710051, 104511541, 135016501, 208226431, 321837921, 311, + * 199820071, 204521391, 229124761, 266028451, 302932131, 312, + * 100010001, 100010001, 100010001, 100010001, 100010001, 313, + * 502665261, 755183501, 901496201, 102410942, 117912812, 320, Ge 32 + * 422848161, 512153401, 557458941, 636270361, 794489061, 321, + * 100010261, 114613921, 175221251, 249828711, 324436181, 322, + * 100010001, 100010001, 100010001, 100010001, 100010001, 323, + * 403143241, 491856701, 649173781, 840396751, 113013392, 330, As 33 + * 593676641, 884697521, 105911572, 129515012, 180322212, 331, + * 484470541, 91510972, 125614082, 157017612, 199722912, 332, + * 100010001, 100010001, 100010001, 100010001, 100010001, 333, + * 630172361, 799686381, 919797221, 102810942, 117712832, 340, Se 34 + * 438055511, 691582151, 94510732, 121413672, 152016732, 341, + * 651982921, 94610382, 113212492, 139515462, 169718482, 342, + * 100010001, 100010001, 100010001, 100010001, 100010001, 343, + * 437347431, 498951671, 538559501, 74710812, 169126672, 350, Br 35 + * 705183611, 93510092, 111614162, 222932532, 427652992, 351, + * 510869921, 87410312, 123116552, 236530712, 377744832, 352, + * 100010001, 100010001, 100010001, 100010001, 100010001, 353/ + data ((nudata(l,m),l=1,6),m=141,160)/ + * 100010001, 100010051, 105012781, 198535971, 65911422, 360, Kr 36 + * 461049811, 522254261, 609088131, 168935052, 68612253, 361, + * 759990901, 101911142, 129017782, 302856642, 99414333, 362, + * 100010001, 100010001, 100010001, 100010001, 100010001, 363, + * 200020011, 200720361, 211523021, 269434141, 459163351, 370, Rb 37 + * 100010001, 100110321, 129524961, 61014202, 291753192, 371, + * 473650891, 533156051, 66810932, 232950852, 99915303, 372, + * 100010001, 100010001, 100010001, 100010001, 100010001, 373, + * 100110041, 104111741, 146019721, 281941411, 607785251, 380, Sr 38 + * 202621931, 255331271, 384347931, 624085761, 122417632, 381, + * 100010001, 100110321, 129524961, 61014202, 291753192, 382, + * 100010001, 100010001, 100010001, 100010001, 100010001, 383, + * 791587851, 100012192, 155119942, 254031782, 389946932, 390, Y 39 + * 118217102, 220827002, 319036792, 416646512, 513256072, 391, + * 92510012, 104710862, 112311612, 120212472, 132814282, 392, + * 100010001, 100010001, 100010001, 100010001, 100010001, 393, + * 141320802, 291439702, 531170262, 92712273, 162521053, 400, Zr 40 + * 354454352, 724689652, 107212643, 148517093, 193321573, 401, + * 209727032, 324537052, 415446282, 510255752, 604965222, 402, + * 100010001, 100010001, 100010001, 100010001, 100010001, 403/ + data ((nudata(l,m),l=1,6),m=161,180)/ + * 256636022, 465759302, 749693962, 116514243, 171520333, 410, Nb 41 + * 335157222, 84511463, 147718363, 221826083, 299933893, 411, + * 223725352, 280830972, 340937362, 406844002, 473150632, 412, + * 100010001, 100010001, 100010001, 100010001, 100010001, 413, + * 703972941, 82610822, 154822682, 327244912, 571469372, 420, Mo 42 + * 75714552, 274347322, 718897632, 123414913, 174920063, 421, + * 267645462, 669890262, 115514323, 173620673, 242528083, 422, + * 100010001, 100010001, 100010001, 100010001, 100010001, 423, + * 90613732, 184823562, 291735332, 419949102, 565764332, 430, Tc 43 + * 131318312, 227126932, 311735452, 397644072, 483852692, 431, + * 204721673, 234725733, 284031463, 348738613, 426546943, 432, + * 100010001, 100010001, 100010001, 100010001, 100010001, 433, + * 176824122, 318941082, 515263202, 761790472, 106112303, 440, Ru 44 + * 221934642, 501968372, 88911173, 136316243, 189221613, 441, + * 210622722, 241025422, 267928262, 297731272, 327834282, 442, + * 100010001, 100010001, 100010001, 100010001, 100010001, 443, + * 148520202, 255230902, 364942462, 489656082, 638872352, 450, Rh 45 + * 153421292, 288137912, 484660322, 720187062, 101011483, 451, + * 254537212, 492362292, 770592182, 107312243, 137615273, 452, + * 100010001, 100010001, 100010001, 100010001, 100010001, 443/ + data ((nudata(l,m),l=1,6),m=181,200)/ + * 115919651, 320746011, 607576761, 95011642, 141817172, 460, Pd 46 + * 755087211, 105913442, 173122222, 282034722, 412247732, 461, + * 180223462, 289735212, 414247632, 538460052, 662672472, 462, + * 100010001, 100010001, 100010001, 100010001, 100010001, 463, + * 200020001, 200220141, 206422141, 257633021, 455164681, 470, Ag 47 + * 100810581, 125817401, 260641031, 66210072, 135316982, 471, + * 795887491, 97711762, 156620252, 248329422, 340038582, 472, + * 100010001, 100010001, 100010001, 100010001, 100010001, 473, + * 100010001, 100410241, 109212891, 176827421, 444268771, 480, Cd 48 + * 200020021, 201720921, 233329881, 451475371, 127520782, 481, + * 100310281, 114815371, 246138311, 519265531, 791492761, 482, + * 100010001, 100010001, 100010001, 100010001, 100010001, 483, + * 252431921, 368440461, 433746521, 512259221, 723389021, 490, In 49 + * 100110071, 104611651, 146118581, 225426511, 304734431, 491, + * 200120111, 205021611, 243628031, 317035371, 390442701, 492, + * 100010001, 100010001, 100010001, 100010001, 100010001, 493, + * 232637101, 488058571, 669074381, 816189091, 97210632, 500, Sn 50 + * 286335941, 408144471, 479351961, 571862901, 686274341, 501, + * 100010251, 114013811, 175321601, 256829751, 338337901, 502, + * 100010001, 100010001, 100010001, 100010001, 100010001, 503/ + data ((nudata(l,m),l=1,6),m=201,220)/ + * 404043481, 494656811, 646772781, 813490751, 101411372, 510, Sb 51 + * 303147981, 618472951, 827392621, 103711702, 131214532, 511, + * 313037601, 429347901, 536260591, 689477591, 862494881, 512, + * 100010001, 100010001, 100010001, 100010001, 100010001, 513, + * 526258801, 657372351, 784284071, 897095741, 102711082, 520, Te 52 + * 440855541, 686481251, 93810792, 125414792, 176321132, 521, + * 349054751, 699883081, 96611302, 134216202, 197724212, 522, + * 100010001, 100010001, 100010001, 100010001, 100010001, 523, + * 405342041, 438645621, 475751071, 587974491, 102214572, 530, I 53 + * 568567471, 773485861, 94510362, 112712182, 130914002, 531, + * 514269581, 86910562, 130716652, 215327742, 351843662, 532, + * 100010001, 100010001, 100010001, 100010001, 100010001, 533, + * 100010001, 100010091, 109515351, 291060661, 119621482, 540, Xe 54 + * 414844131, 465649111, 538464651, 87112232, 158019362, 541, + * 615475101, 867797531, 112213462, 157618062, 203622662, 542, + * 100010001, 100010001, 100010001, 100010001, 100010001, 543, + * 200020001, 201020501, 215623871, 283536181, 462756261, 550, Cs 55 + * 100010001, 100310371, 119016501, 269146361, 77912412, 551, + * 424445601, 481750061, 516953311, 549356551, 581759791, 552, + * 100010001, 100010001, 100010001, 100010001, 100010001, 553/ + data ((nudata(l,m),l=1,6),m=221,240)/ + * 101210791, 135119351, 282340571, 574580391, 111015062, 560, Ba 56 + * 262638611, 504160621, 698579371, 91010692, 129115952, 561, + * 100010001, 100310351, 118416321, 264945521, 76512182, 562, + * 100010001, 100010001, 100010001, 100010001, 100010001, 563, + * 71111992, 172323592, 312540402, 510763182, 765791012, 570, La 57 + * 204529582, 383647882, 582469262, 807992692, 104911723, 571, + * 94712552, 148416582, 179819212, 203621522, 227424042, 572, + * 100010001, 100010001, 100010001, 100010001, 100010001, 573, + * 295959132, 103515693, 215527593, 335939413, 449650223, 580, Ce 58 + * 79718153, 289639443, 495159253, 686877533, 863794813, 581, + * 298640242, 475053692, 596965912, 725379692, 872094692, 582, + * 100010001, 100010001, 100010001, 100010001, 100010001, 583, + * 460693672, 158523823, 327242303, 519661563, 709379783, 590, Pr 59 + * 455480232, 114014653, 178521013, 240927073, 299232633, 591, + * 46410533, 183826893, 354443773, 518459633, 674375243, 592, + * 100010001, 100010001, 100010001, 100010001, 100010001, 593, + * 139623042, 364860002, 96114603, 209828633, 373446973, 600, Nd 60 + * 460493692, 158523823, 327142303, 519661563, 709279783, 601, + * 455480232, 114014653, 178521013, 240927073, 299232633, 602, + * 100010001, 100010001, 100010001, 100010001, 100010001, 603/ + data ((nudata(l,m),l=1,6),m=241,260)/ + * 131720482, 280535692, 441254492, 676583972, 103412583, 610, Pm 61 + * 139623042, 364860002, 96114603, 209828633, 373446973, 611, + * 460493682, 158523823, 327142303, 519661563, 709279783, 612, + * 100010001, 100010001, 100010001, 100010001, 100010001, 613, + * 92915672, 222431062, 444763802, 89612173, 159520253, 620, Sm 62 + * 315059662, 97114563, 204627093, 342541693, 490556383, 621, + * 269037812, 520270372, 91111273, 133915483, 172719093, 622, + * 100010001, 100010001, 100010001, 100010001, 100010001, 623, + * 800080571, 851699301, 127617362, 240433032, 444958442, 630, Eu 63 + * 125416052, 211828182, 375549622, 644381732, 101112213, 631, + * 800080571, 851699301, 127617362, 240433032, 444958442, 632, + * 100010001, 100010001, 100010001, 100010001, 100010001, 633, + * 240432982, 427555202, 708489962, 112613853, 167319843, 640, Gd 64 + * 534793262, 139219123, 247730843, 371043333, 495055893, 641, + * 364145232, 514756362, 604864112, 673870372, 732276072, 642, + * 100010001, 100010001, 100010001, 100010001, 100010001, 643, + * 480767202, 89011393, 144118243, 230028753, 354142883, 650, Yb 65 + * 480767192, 89011393, 144118243, 230028753, 354142883, 651, + * 480767202, 89011393, 144118243, 230028753, 354142883, 652, + * 100010001, 100010001, 100010001, 100010001, 100010001, 653/ + data ((nudata(l,m),l=1,6),m=261,280)/ + * 343147532, 645887152, 115314793, 183322063, 257729373, 660, Dy 66 + * 343147532, 645887142, 115314793, 183322063, 257729373, 661, + * 343147532, 645887142, 115314793, 183322063, 257729373, 662, + * 100010001, 100010001, 100010001, 100010001, 100010001, 663, + * 222635002, 542276772, 100312353, 145716713, 187020703, 670, Ho 67 + * 222635002, 542276772, 100312353, 145716713, 187020703, 671, + * 222635002, 542276772, 100312353, 145716713, 187020703, 672, + * 100010001, 100010001, 100010001, 100010001, 100010001, 673, + * 133715382, 209130152, 429859382, 79410293, 129815983, 680, Er 68 + * 265934782, 497877532, 120517733, 245032063, 400448073, 681, + * 265934782, 497877532, 120517733, 245032063, 400448073, 682, + * 100010001, 100010001, 100010001, 100010001, 100010001, 683, + * 800381111, 87510702, 147621462, 310343462, 585475982, 690, Tm 69 + * 156718872, 279244452, 678196342, 128316243, 197823443, 691, + * 93517192, 364666132, 103414613, 192624193, 293334613, 692, + * 100010001, 100010001, 100010001, 100010001, 100010001, 693, + * 100010011, 101310651, 118613951, 169120661, 250629971, 700, Yb 70 + * 200120901, 270345231, 81714042, 223533112, 461959862, 701, + * 100312561, 250851931, 91914182, 198626022, 323638692, 702, + * 100010001, 100010001, 100010001, 100010001, 100010001, 703/ + data ((nudata(l,m),l=1,6),m=281,300)/ + * 514664441, 759086851, 99211442, 133315612, 182721252, 710, Lu 71 + *-125924831, 438667801, 98714112, 199727872, 380850742, 711, + * 323948621, 661297271, 158626482, 426865032, 93712843, 712, + * 100010001, 100010001, 100010001, 100010001, 100010001, 713, + * 659294081, 128016962, 222528952, 372047062, 585171462, 720, Hf 72 + * 99117882, 274638812, 520867322, 84410313, 123314453, 721, + * 187427702, 343739872, 448049452, 539358282, 625266642, 722, + * 100010001, 100010001, 100010001, 100010001, 100010001, 723, + * 65210892, 171325762, 373552252, 705192012, 116414343, 730, Ta 73 + * 192837842, 600784802, 111113823, 165419233, 218524383, 731, + * 99117872, 274638812, 520867312, 84410313, 123314453, 732, + * 100010001, 100010001, 100010001, 100010001, 100010001, 733, + * 398981651, 130019172, 273438022, 516168382, 88411163, 740, Wl 74 + * 131429482, 523279952, 111414623, 183422233, 262130233, 741, + * 192837842, 600784792, 111113823, 165419233, 218524383, 742, + * 100010001, 100010001, 100010001, 100010001, 100010001, 743, + * 600963001, 75910412, 150121572, 301940972, 539168952, 750, Re 75 + * 73710852, 190731262, 464964142, 83810503, 127315053, 751, + * 131429482, 523279952, 111414623, 183422233, 262130233, 752, + * 100010001, 100010001, 100010001, 100010001, 100010001, 753/ + data ((nudata(l,m),l=1,6),m=301,320)/ + * 110815502, 216829732, 398752322, 672484682, 104612673, 760, Os 76 + * 168225972, 362046562, 566766422, 757484612, 93010103, 761, + * 73710852, 190731262, 464964142, 83810503, 127315053, 762, + * 100010001, 100010001, 100010001, 100010001, 100010001, 763, + * 129117892, 239430882, 388748292, 596173252, 89510843, 770, Ir 77 + * 110815502, 216829732, 398752322, 672484682, 104612673, 771, + * 168225972, 362046562, 566766422, 757484612, 93010103, 772, + * 100010001, 100010001, 100010001, 100010001, 100010001, 773, + * 158918512, 207523002, 254328242, 316335762, 407246582, 780, Pt 78 + * 98115462, 224930742, 401150612, 623475412, 89910583, 781, + * 110815502, 216829732, 398752322, 672484682, 104612673, 782, + * 100010001, 100010001, 100010001, 100010001, 100010001, 783, + * 203222611, 265731251, 364042301, 494958601, 702084731, 790, Au 79 + * 120521331, 357753801, 75310062, 130516572, 206925452, 791, + * 651780821, 108814772, 195925252, 316338622, 460853882, 792, + * 100010001, 100010001, 100010001, 100010001, 100010001, 793, + * 100010001, 100110111, 105211851, 152122101, 341552811, 800, Hg 80 + * 200320211, 210023021, 268834231, 480472341, 111416912, 801, + * 104012871, 186129471, 458664151, 82410072, 119013732, 802, + * 100010001, 100010001, 100010001, 100010001, 100010001, 803/ + data ((nudata(l,m),l=1,6),m=321,340)/ + * 200420711, 222424271, 265429161, 325637371, 442853911, 810, Tl 81 + * 100010021, 101910801, 121414641, 189525811, 358949721, 811, + * 200020311, 216624611, 296337451, 489064791, 85711212, 812, + * 100010001, 100010001, 100010001, 100010001, 100010001, 813, + * 103411711, 147819101, 244331781, 434862751, 93113762, 820, Pb 82 + * 204122231, 248227841, 311535621, 429153941, 651976431, 821, + * 100210131, 106812201, 154522671, 381665951, 95512512, 822, + * 100010001, 100010001, 100010001, 100010001, 100010001, 823, + * 400140351, 416944121, 474851591, 564362181, 690477231, 830, Bi 83 + * 106814451, 204427341, 350744811, 586879131, 108314772, 831, + * 205523051, 264830231, 345439921, 469156001, 675281671, 832, + * 100010001, 100010001, 100010001, 100010001, 100010001, 833, + * 500950661, 518153561, 559058941, 628968071, 748483501, 840, Po 84 + * 443756241, 696282451, 95411012, 128615262, 182922012, 841, + * 336953201, 682481011, 93810882, 127915272, 184622442, 842, + * 100010001, 100010001, 100010001, 100010001, 100010001, 843, + * 402841621, 431544771, 463148311, 520059491, 734896851, 850, At 85 + * 576168741, 788387631, 96910642, 116012552, 135014462, 851, + * 490265341, 812797201, 116614322, 179622692, 285035302, 852, + * 100010001, 100010001, 100010001, 100010001, 100010001, 853/ + data ((nudata(l,m),l=1,6),m=341,360)/ + * 100010001, 100010031, 102311051, 133018071, 264539391, 860, Rn 86 + * 402841621, 431544771, 463148311, 520059491, 734996851, 861, + * 576168741, 788387631, 96910642, 116012552, 135014462, 862, + * 100010001, 100010001, 100010001, 100010001, 100010001, 863, + * 200020011, 201220591, 218124481, 296538611, 488859141, 870, Fr 87 + * 100010001, 100010031, 102311051, 133018071, 264539401, 871, + * 421645151, 477449611, 511852711, 542455761, 572958821, 872, + * 100010001, 100010001, 100010001, 100010001, 100010001, 873, + * 100010041, 105212131, 153220271, 270435641, 460258111, 880, Ra 88 + * 201221791, 258131471, 381645781, 546365131, 777592781, 881, + * 100010001, 100010031, 102311051, 133018071, 264539391, 882, + * 100010001, 100010001, 100010001, 100010001, 100010001, 883, + * 510064491, 82710872, 142718412, 232328712, 348341572, 890, Ac 89 + * 228951571, 88513232, 183324132, 305537492, 448152402, 891, + * 723989131, 103511752, 130814352, 155416652, 177018682, 892, + * 100010001, 100010001, 100010001, 100010001, 100010001, 893, + * 620099241, 162725772, 391457072, 80110833, 141818023, 900, Th 90 + * 620099241, 162725772, 391457072, 80110833, 141818023, 901, + * 620099251, 162725772, 391457072, 80110833, 141818023, 902, + * 100010001, 100010001, 100010001, 100010001, 100010001, 903/ + data ((nudata(l,m),l=1,6),m=361,380)/ + * 347877992, 129318323, 240730533, 380546863, 570368573, 910, Pa 91 + * 347877992, 129318323, 240730533, 380546863, 570368573, 911, + * 347777992, 129318323, 240730533, 380546863, 570368573, 912, + * 100010001, 100010001, 100010001, 100010001, 100010001, 913, + * 209530092, 450866762, 96613623, 186524763, 318839893, 920, U 92 + * 209530092, 450866762, 96613623, 186524763, 318839893, 921, + * 209530092, 450866762, 96613623, 186524763, 318839893, 922, + * 100010001, 100010001, 100010001, 100010001, 100010001, 933, + * 209530092, 450866762, 96613623, 186524763, 318839893, 930, Np 93 + * 209530092, 450866762, 96613623, 186524763, 318839893, 931, + * 209530092, 450866762, 96613623, 186524763, 318839893, 932, + * 100010001, 100010001, 100010001, 100010001, 100010001, 933, + * 209530092, 450866762, 96613623, 186524763, 318839893, 940, Pu 94 + * 209530092, 450866762, 96613623, 186524763, 318839893, 941, + * 209530092, 450866762, 96613623, 186524763, 318839893, 942, + * 100010001, 100010001, 100010001, 100010001, 100010001, 943, + * 209530092, 450866762, 96613623, 186524763, 318839893, 950, Am 95 + * 209530092, 450866762, 96613623, 186524763, 318839893, 951, + * 209530092, 450866762, 96613623, 186524763, 318839893, 952, + * 100010001, 100010001, 100010001, 100010001, 100010001, 953/ + +c the *partflag* array signals that a species has a revised partition +c function by having a non-zero value in the array position for that +c species; the non-zero number then points to the correct data in +c the *newpartdata* array of updated coefficients. For example, +c partflag(24,2) = 01, meaning that Cr II has updated partition function +c coefficients, which can be found in newpartdata(01,1,...,6) + data ((partflag(l,m),m=1,4),l= 1,40)/ + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Be 04 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, O 08 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Mg 12 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, S 16 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Ca 20 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 01, 0, 0, Cr 24 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Ni 28 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Ge 32 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Kr 36 + . 02, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0/ Zr 40 + data ((partflag(l,m),m=1,4),l=41,80)/ + . 0, 0, 0, 0, 0, 03, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Ru 44 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Cd 48 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Te 52 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Ba 56 + . 0, 0, 0, 0, 0, 0, 0, 0, 04, 05, 0, 0, 06, 07, 0, 0, Nd 60 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 21, 0, 08, 0, 0, 0, Gd 64 + . 09, 10, 22, 0, 11, 12, 23, 0, 0, 13, 24, 0, 14, 15, 25, 0, Er 68 + . 0, 0, 0, 0, 16, 0, 0, 0, 0, 17, 0, 0, 0, 0, 0, 0, Hf 72 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Os 76 + . 0, 28, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0/ Hg 80 + data ((partflag(l,m),m=1,4),l=81,95)/ + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Po 84 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, Ra 88 + . 0, 0, 0, 0, 18, 19, 26, 0, 0, 0, 0, 0, 0, 20, 27, 0, U 92 + . 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 / + +c Cr II new partition function coefficients + data (newpartdata(01,i),i=1,6)/ 2.66384894d+3, -1.68227473d+3, + . 4.22830259d+2, -5.28071678d+1, 3.27472214d+0, -8.05963460d-2/ +c Rb I new partition function coefficients + data (newpartdata(02,i),i=1,6)/ 5.03676283d+3, -3.16069504d+3, + . 7.89175381d+2, -9.79501783d+1, 6.04047992d+0, -1.47981323d-1/ +c Mo II new partition function coefficients + data (newpartdata(03,i),i=1,6)/ 4.16034835d+3, -2.65480884d+3, + . 6.74631372d+2, -8.52665787d+1, 5.35745654d+0, -1.33793443d-1/ +c Pr I new partition function coefficients + data (newpartdata(04,i),i=1,6)/ -3.04466224d+3, 1.88966140d+3, + . -4.64804826d+2, 5.66502603d+1, -3.42059183d+0, 8.19184298d-2/ +c Pr II new partition function coefficients (modified June 25, 2008) + data (newpartdata(05,i),i=1,6)/ -1.91609088d+3, 1.18545447d+3, + . -2.90543602d+2, 3.52740316d+1, -2.12000090d+0, 5.04914504d-2/ +c Nd I new partition function coefficients + data (newpartdata(06,i),i=1,6)/ -1.64889203d+3, 9.47177848d+2, + . -2.12837179d+2, 2.33051095d+1, -1.23575686d+0, 2.52043511d-2/ +c Nd II new partition function coefficients + data (newpartdata(07,i),i=1,6)/ -2.06698421d+2, 9.79972763d+1, + . -1.55582617d+1, 7.28892861d-1, 3.56166693d-2, -2.95215536d-3/ +c Gd I new partition function coefficients + data (newpartdata(08,i),i=1,6)/ 1.83011048d+3, -1.19539486d+3, + . 3.10632505d+2, -4.00859062d+1, 2.56842403d+0, -6.53128117d-2/ +c Tb I new partition function coefficients + data (newpartdata(09,i),i=1,6)/ 5.85584746d+2, -3.89743229d+2, + . 1.03759088d+2, -1.37350828d+1, 9.03674535d-1, -2.35845042d-2/ +c Tb II new partition function coefficients + data (newpartdata(10,i),i=1,6)/ -9.48002791d+2, 6.16808235d+2, + . -1.58524150d+2, 2.01610509d+1, -1.26856460d+0, 3.16355813d-2/ +c Dy I new partition function coefficients + data (newpartdata(11,i),i=1,6)/ 3.53878819d+3, -2.31997287d+3, + . 6.06023177d+2, -7.87382964d+1, 5.08456496d+0, -1.30426644d-1/ +c Dy II new partition function coefficients + data (newpartdata(12,i),i=1,6)/ 2.77061687d+3, -1.78523018d+3, + . 4.58361896d+2, -5.85341812d+1, 3.71600397d+0, -9.37402524d-2/ +c Ho II new partition function coefficients + data (newpartdata(13,i),i=1,6)/ 1.34187596d+3, -8.52533583d+2, + . 2.15784324d+2, -2.71271661d+1, 1.69281185d+0, -4.19020326d-2/ +c Er I new partition function coefficients + data (newpartdata(14,i),i=1,6)/ 2.02411710d+3, -1.35836078d+3, + . 3.62878018d+2, -4.81385931d+1, 3.16795944d+0, -8.26308027d-2/ +c Er II new partition function coefficients + data (newpartdata(15,i),i=1,6)/ 1.62058945d+3, -1.06472504d+3, + . 2.78625547d+2, -3.62193240d+1, 2.33715989d+0, -5.98219225d-2/ +c Yb I new partition function coefficients + data (newpartdata(16,i),i=1,6)/ 7.47839800d+3, -4.67427018d+3, + . 1.16206341d+3, -1.43581759d+2, 8.81293038d+0, -2.14850223d-1/ +c Lu II new partition function coefficients + data (newpartdata(17,i),i=1,6)/ 2.44026764d+3, -1.59016793d+3, + . 4.12298445d+2, -5.31395892d+1, 3.40232351d+0, -8.65004469d-2/ +c Th I new partition function coefficients + data (newpartdata(18,i),i=1,6)/ 4.76054139d+2, -3.25783548d+2, + . 8.97134083d+1, -1.23483587d+1, 8.46088455d-1, -2.29570332d-2/ +c Th II new partition function coefficients + data (newpartdata(19,i),i=1,6)/ -1.22179869d+3, 7.59698688d+2, + . -1.86944859d+2, 2.27591989d+1, -1.37021999d+0, 3.26865578d-2/ +c U II new partition function coefficients + data (newpartdata(20,i),i=1,6)/ -2.76709404d+2, 1.30426239d+2, + . -2.06221054d+1, 9.83307627d-1, 4.19297328d-2, -3.60428836d-3/ +c Eu III partition function coefficients (Irwin 1981) + data (newpartdata(21,i),i=1,6)/ -2.02846263d+3, 1.24521575d+3, + . -3.04725159d+2, 3.72010364d+1, -2.26584074d+0, 5.50893177d-2/ +c Tb III partition function coefficients (Irwin 1981) + data (newpartdata(22,i),i=1,6)/ 8.11558123d+2, -4.67434582d+2, + . 1.07583056d+2, -1.23251149d+1, 7.02860514d-1, -1.59394115d-2/ +c Dy III partition function coefficients (Irwin 1981) + data (newpartdata(23,i),i=1,6)/ 1.30822682d+3, -7.46679156d+2, + . 1.69716518d+2, -1.91592590d+1, 1.07376244d+0, -2.38653520d-2/ +c Ho III partition function coefficients (Irwin 1981) + data (newpartdata(24,i),i=1,6)/ 6.98122851d+3, -4.11418184d+3, + . 9.66307217d+2, -1.13063284d+2, 6.59141456d+0, -1.53163679d-1/ +c Er III partition function coefficients (Irwin 1981) + data (newpartdata(25,i),i=1,6)/ 2.65562213d+3, -1.49666461d+3, + . 3.34740125d+2, -3.70678109d+1, 2.02963822d+0, -4.38640816d-2/ +c Th III partition function coefficients (Irwin 1981) + data (newpartdata(26,i),i=1,6)/ 7.10076650d+3, -4.15762991d+3, + . 9.69365844d+2, -1.12510812d+2, 6.50161887d+0, -1.49626283d-1/ +c U III partition function coefficients (Irwin 1981) + data (newpartdata(27,i),i=1,6)/ 5.18480529d+3, -3.02564444d+3, + . 7.03396006d+2, -8.14028851d+1, 4.68959696d+0, -1.07563314d-1/ +c Ir II partition function coefficients (Irwin 1981) + data (newpartdata(28,i),i=1,6)/ 2.33935909d+2, -1.43786065d+2, + . 3.57641903d+1, -4.45430703d+0, 2.77258541d-1, -6.86047013d-3/ + + + end + @@ -0,0 +1,138 @@ + + subroutine begin +c*************************************************************************** +c This routine simply starts up MOOG +c THIS VERSION IS FOR LINUX REDHAT MACHINES +c*************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Pstuff.com' + character*80 line, systemcall + integer num + + +c*****define the number of text screen lines for silent mode; +c this number is hardwired, since it is not really needed at run time. + if (silent .eq. 'y') then + maxline = 24 + write (*,*) 'maxline', maxline + pause + go to 10 + endif + + +c*****define the number of lines available on the text screen for +c interactive mode; this number is discovered from the "stty -a" +c command, for which the output format is unique to the operating +c system. + write (systemcall,*) 'stty -a > tmpsize' + call system (systemcall) + open (99,file='tmpsize') +5 read (99,1010,end=15) line + do i=1,77 + if (line(i:i+3) .eq. 'rows') then + if (machine .eq. 'pcl') then + read (line(i+4:i+6),1011) maxline + elseif (machine .eq. 'mac') then + read (line(i-4:i-2),1011) maxline + elseif (machine .eq. 'uni') then + read (line(i+6:i+8),1011) maxline + endif + go to 10 + endif + enddo + go to 5 +15 array = 'SCREEN ROW COUNT UNKNOWN; USE 24 ([y]/n)? ' + nchars = 42 + ikount = 2 + call getasci (nchars,ikount) + choice = chinfo(1:1) + if (choice.eq.'y' .or. nchars.le.0) then + go to 10 + else + call finish (0) + endif +10 close (99,status='delete') + write (systemcall,*) '\\rm -f tmpsize' + call system (systemcall) + if (maxline .lt. 10) then + maxline = 24 + else + maxline = maxline - 2 + endif + + +c*****clear the text screen + write (systemcall,*) 'clear' + call system (systemcall) + + +c*****open data files carried with the source code: Barklem damping + nfbarklem = 35 + num = 60 + call getcount (num,moogpath) + if (moogpath(num:num) .ne. '/') then + num = num + 1 + moogpath(num:num) = '/' + endif + fbarklem(1:num) = moogpath(1:num) + fbarklem(num+1:num+11) = 'Barklem.dat' + open (nfbarklem,file=fbarklem) + + +c*****open data files carried with the source code: Barklem UV damping + nfbarklemUV = 36 + num = 60 + call getcount (num,moogpath) + if (moogpath(num:num) .ne. '/') then + num = num + 1 + moogpath(num:num) = '/' + endif + fbarklemUV(1:num) = moogpath(1:num) + fbarklemUV(num+1:num+13) = 'BarklemUV.dat' + open (nfbarklemUV,file=fbarklemUV) + + +c write a header and find the appropriate parameter file, and exit normally + write (array,1001) + istat = ivwrite (1,1,array,79) + write (array,1004) + istat = ivwrite (2,1,array,79) + array = 'MOOG PARAMETERS? ' + nchars = 15 + nfparam = 50 + lscreen = 4 + if (silent .eq. 'y') then + fparam = 'batch.par' + else + fparam = 'no_filename_given' + endif + call infile ('input ',nfparam,'formatted ',0,nchars, + . fparam,lscreen) + read (nfparam,1002) control + write (array,1003) control + istat = ivwrite (2,1,array,58) + write (array,1001) + istat = ivwrite (3,1,array,79) + return + + +c*****format statements +1001 format (79('*')) +1002 format (a7) +1003 format (22x,'MOOG IS CONTROLLED BY DRIVER ',a7) +1004 format (25(' '),'MOOG LTE VERSION (NOV 2019)',26(' ')) +1010 format (a80) +1011 format (i3) + + + end + + + + + + + + diff --git a/Binary.f b/Binary.f new file mode 100755 index 0000000..e7043b2 --- /dev/null +++ b/Binary.f @@ -0,0 +1,198 @@ + + subroutine binary +c****************************************************************************** +c This program synthesizes a section of a spectroscopic binary star +c spectrum, using one model atmosphere for the primary and one model +c for the secondary, and then compares it to an observed spectrum. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Factor.com' + include 'Mol.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Equivs.com' + include 'Multistar.com' + integer ncall + + +c*****examine the parameter file + begin = 0 + ncall = 1 +1 call params + linprintopt = linprintalt + if (begin .eq. 0) then + if (numpecatom .gt. 0) then + do i=3,95 + binpec(syncount,i) = pec(i) + do j=1,numatomsyn + binpecabund(syncount,i,j) = pecabund(i,j) + enddo + enddo + endif + else + if (numpecatom .gt. 0) then + do i=3,95 + pec(i) = binpec(syncount,i) + do j=1,numatomsyn + pecabund(i,j) = binpecabund(syncount,i,j) + enddo + enddo + endif + endif + + +c*****open the files for: standard output, raw spectrum depths, smoothed +c spectra, and (if desired) IRAF-style smoothed spectra + istat = ivcleof(5,1) + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = lscreen + 2 + array = 'RAW SYNTHESIS OUTPUT' + nchars = 20 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + if (syncount .eq. 1) then + f7out = f2out + else + f8out = f2out + endif + if (iraf .ne. 0) then + nf4out = 23 + lscreen = lscreen + 2 + array = 'IRAF ("rtext") OUTPUT' + nchars = 24 + call infile ('output ',nf4out,'formatted ',0,nchars, + . f4out,lscreen) + endif + + +c*****open and read the model atmosphere file + nfmodel = 30 + lscreen = lscreen + 2 + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****open the line list file and the strong line list file + nflines = 31 + lscreen = lscreen + 2 + array = 'THE LINE LIST' + nchars = 13 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + if (dostrong .gt. 0) then + nfslines = 32 + lscreen = lscreen + 2 + array = 'THE STRONG LINE LIST' + nchars = 20 + call infile ('input ',nfslines,'formatted ',0,nchars, + . fslines,lscreen) + endif + + +c*****do the syntheses + if (numpecatom .eq. 0 .or. numatomsyn .eq. 0) then + isorun = 1 + nlines = 0 + mode = 3 + call inlines (1) + call eqlib + call nearly (1) + call synspec + else + do n=1,numatomsyn + isynth = n + isorun = 1 + start = oldstart + sstop = oldstop + mode = 3 + call inlines (1) + call eqlib + call nearly (1) + call synspec + linprintopt = 0 + enddo + endif + if (syncount .eq. 1) then + fluxprimary = flux + else + fluxsecondary = flux + endif + + +c*****finish the syntheses + call finish (1) + istat = ivcleof(4,1) + if (control .ne. 'gridend') go to 1 + + +c*****combine the synthetic spectra for plotting + call binplotprep + + +c*****now plot the spectrum, maybe iterating abundances, and end the program + if (plotopt.eq.2 .and. specfileopt.gt.0) then + nfobs = 33 + lscreen = lscreen + 2 + array = 'THE OBSERVED SPECTRUM' + nchars = 21 + if (specfileopt.eq.1 .or. specfileopt.eq.3) then + call infile ('input ',nfobs,'unformatted',2880,nchars, + . fobs,lscreen) + else + call infile ('input ',nfobs,'formatted ',0,nchars, + . fobs,lscreen) + endif + endif + if (plotopt .ne. 0) then + control = 'binary ' + nf2out = nf9out + nf3out = nf10out + call pltspec (lscreen,ncall) + if (choice .eq. 'n') then + do syncount=1,2 + if (numpecatom .gt. 0) then + do i=3,95 + pec(i) = binpec(syncount,i) + do j=1,numatomsyn + pecabund(i,j) = binpecabund(syncount,i,j) + enddo + enddo + endif + call chabund + do i=3,95 + binpec(syncount,i) = pec(i) + do j=1,numatomsyn + binpecabund(syncount,i,j) = pecabund(i,j) + enddo + enddo + enddo + call finish (1) + linecount = 0 + oldcount = 0 + begin = begin + 1 + choice = '1' + ncall = 2 + go to 1 + endif + endif + + call finish (0) + + end + + + + + + diff --git a/Binplot.f b/Binplot.f new file mode 100755 index 0000000..edb727f --- /dev/null +++ b/Binplot.f @@ -0,0 +1,322 @@ + + subroutine binplot +c****************************************************************************** +c This routine produces MONGO plots of the syntheses. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Quants.com' + include 'Factor.com' + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Equivs.com' + include 'Multistar.com' + real*4 style(1) + real*4 yup,ydown + integer iflip + + +c*****for grid syntheses, dump out relevant information to a file + if (choice .eq. 'g') then + write (nf6out,3001) syncount + write (nf6out,3002) obsitle, moditle, smitle + endif + + +c*****begin with a default window + call sm_location (3500,31000,4000,30000) + call sm_window (1,1,1,1,1,1) + call sm_limits (0.0,1.0,0.0,1.0) + call defcolor (1) + + +c*****write smoothing information at the top of the plot + call sm_lweight (2.2) + call sm_expand (0.7) + call sm_relocate (-0.080,1.015) + call sm_label (smitle) + write (chinfo(1:34),3004) deltaradvel, lumratio + call sm_relocate (0.500,1.015) + call sm_label (chinfo(1:30)) + + +c*****write the non-varying isotopic information at the top of the plot + do i=1,120 + if (isoitle(i:i) .ne. ' ') go to 112 + enddo + isoitle(1:16) = 'no isotopic data' +112 call sm_relocate (-0.080,1.065) + call sm_label (isoitle(1:120)) + + +c*****define the real plot limits + if (xlo .lt. xhi) then + call sm_limits (xlo,xhi,ylo,yhi) + iflip = 0 + else + call sm_limits (xhi,xlo,ylo,yhi) + iflip = 1 + endif + call findtic (xlo,xhi,bigxtic,smlxtic) + call findtic (ylo,yhi,bigytic,smlytic) + call sm_ticksize (smlxtic,bigxtic,smlytic,bigytic) + + +c*****draw and label the box for the spectra + call defcolor (1) + if (whichwin .eq. '1of1') then + idev = 1 + call sm_window (1,1,1,1,1,1) + else + idev = 2 + call sm_defvar ('y_gutter','0.0') + call sm_window (1,2,1,1,1,1) + endif + call sm_lweight (4.0) + call sm_expand (1.2) + call sm_box (0,0,0,0) + call sm_lweight (2.0) + call sm_expand (0.8) + call sm_box (1,2,4,4) + if (iflip .eq. 1) then + array = 'Wavenumber' + else + array = 'Wavelength' + endif + call sm_xlabel (array) + array = 'Rel Flux' + call sm_ylabel (array) + + +c*****plot the synthetic spectra + call sm_lweight (2.2) + call sm_expand (0.7) + do i=1,100 + if (pec(i) .ne. 0) go to 111 + enddo +111 do j=1,nsyn + if (choice.eq.'h' .or. choice.eq.'f' .or. + . choice.eq.'g') then + call defcolor (8) + call sm_ltype (j-1) + else + if (smterm(1:3) .eq. 'x11') then + call defcolor (j+1) + call sm_ltype (0) + else + call defcolor (1) + call sm_ltype (j-1) + endif + endif + call sm_connect (xsyn,chunk(1,j),kount) + if (iflip .eq. 1) then + call sm_relocate (xhi+0.045*(xlo-xhi), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + call sm_draw (xhi+0.005*(xlo-xhi), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + call sm_relocate (xhi+0.05*(xlo-xhi), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + else + call sm_relocate (xlo+0.045*(xhi-xlo), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + call sm_draw (xlo+0.005*(xlo-xhi), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + call sm_relocate (xlo+0.05*(xhi-xlo), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + endif + noff = 80*(j-1) + call sm_lweight (2.2) + call sm_label (abitle(noff+1:noff+80)) + enddo + call defcolor (1) + call sm_ltype (0) + + +c*****plot the observed spectrum + if (plotopt .eq. 2) then + call defcolor (1) + if (choice.eq.'h' .or. choice.eq.'f') then + call sm_lweight (4.0) + else + call sm_lweight (2.2) + endif + call sm_ltype (0) + call sm_expand (3.0) + style(1) = 43.5 + call sm_ptype (style,1) + mount = lim2obs - lim1obs + 1 + if (mount .lt. 500) then + call sm_points (xobs(lim1obs),yobs(lim1obs),mount) + else + if (histoyes .eq. 1) then + call sm_histogram (xobs(lim1obs),yobs(lim1obs),mount) + else + call sm_connect (xobs(lim1obs),yobs(lim1obs),mount) + endif + endif + call sm_lweight (2.2) + call sm_expand (0.7) + if (iflip .eq. 1) then + call sm_relocate (xhi+0.05*(xlo-xhi),ylo+0.12*(yhi-ylo)) + else + call sm_relocate (xlo+0.05*(xhi-xlo),ylo+0.12*(yhi-ylo)) + endif + call sm_label (obsitle) + endif + do i=1,2 + if (iflip .eq. 1) then + call sm_relocate (xhi+0.05*(xlo-xhi), + . ylo+0.01+0.06*(2-i)*(yhi-ylo)) + else + call sm_relocate (xlo+0.05*(xhi-xlo), + . ylo+0.01+0.06*(2-i)*(yhi-ylo)) + endif + call sm_label (modbin(i)) + enddo + if (whichwin.eq.'1of1' .or. plotopt.ne.2) then + return + endif + + +c*****this section of code is executed only if a deviations plot is desired; +c find the starting and stopping points in the arrays for the deviations + if (xsyn(kount) .le. xobs(lim1obs)) go to 1000 + if (xsyn(1) .gt. xobs(lim2obs)) go to 1000 + if (xsyn(1) .gt. xobs(lim1obs)) go to 150 + lim3obs = lim1obs + do k=2,kount + if (xsyn(k) .gt. xobs(lim3obs)) then + lim1syn = k - 1 + go to 155 + endif + enddo +150 lim1syn = 1 + do l=lim1obs,lim2obs + if (xsyn(lim1syn) .le. xobs(l)) then + lim3obs = l + go to 155 + endif + enddo +155 if (xsyn(kount) .lt. xobs(lim2obs)) go to 160 + lim4obs = lim2obs + do k=lim1syn,kount + if (xsyn(k) .gt. xobs(lim4obs)) then + lim2syn = k + go to 165 + endif + enddo +160 lim2syn = kount + do l=lim3obs,lim2obs + if (xsyn(lim2syn) .lt. xobs(l)) then + lim4obs = l - 1 + go to 165 + endif + enddo + + +c compute the deviations; linear interpolation in the wavelength array +c of the synthetic spectra is considered sufficient +165 do j=1,nsyn + lpoint = lim1syn + devsigma = 0. + do i=lim3obs,lim4obs +170 if (xsyn(lpoint+1) .lt. xobs(i)) then + lpoint = lpoint + 1 + go to 170 + endif + syninterp = (chunk(lpoint+1,j)-chunk(lpoint,j))* + . (xobs(i)-xsyn(lpoint))/(xsyn(lpoint+1)-xsyn(lpoint)) + + . chunk(lpoint,j) + dev(i) = yobs(i) - syninterp + devsigma = devsigma + dev(i)**2 + enddo + devsigma = dsqrt(devsigma/(lim4obs-lim3obs-1)) + + +c from first set of deviations, define the plot limits, draw and label box + if (j .eq. 1) then + yup = -1000. + ydown = +1000. + do i=lim3obs,lim4obs + yup = amax1(yup,dev(i)) + ydown = amin1(ydown,dev(i)) + enddo + ydelta = amin1(0.3,amax1(0.05,1.5*(yup-ydown)/2.)) + ydown = -ydelta + yup = ydelta + call sm_defvar ('y_gutter','0.0') + call sm_window (1,2,1,2,1,2) + call sm_limits (xlo,xhi,ydown,yup) + call findtic (ydown,yup,bigytic,smlytic) + call sm_ticksize (smlxtic,bigxtic,smlytic,bigytic) + call sm_lweight (4.0) + call sm_expand (1.2) + call defcolor (1) + call sm_box (0,0,0,0) + call sm_lweight (2.0) + call sm_expand (0.8) + call sm_box (4,2,4,4) + array = 'Obs - Comp' + call sm_ylabel (array) + call sm_relocate (xlo,0.0) + call sm_draw (xhi,0.0) + endif + + +c plot the array of deviations + if (choice.eq.'h' .or. choice.eq.'f' .or. + . choice.eq.'g') then + call defcolor (8) + call sm_ltype (j-1) + else + if (smterm(1:3) .eq. 'x11') then + call defcolor (j+1) + call sm_ltype (0) + else + call defcolor (1) + call sm_ltype (j-1) + endif + endif + call defcolor (j+1) + call sm_lweight (2.2) + call sm_connect (xobs(lim1obs),dev(lim1obs),mount) + write (array,3005) devsigma + call sm_relocate(xhi-0.2*(xhi-xlo), + . ydown+(0.10+0.06*j)*(yup-ydown)) + call sm_relocate(xhi-0.24*(xhi-xlo), + . ydown+(0.10+0.06*j)*(yup-ydown)) + call sm_draw(xhi-0.215*(xhi-xlo), + . ydown+(0.10+0.06*j)*(yup-ydown)) + call sm_label (array) + if (choice .eq. 'g') then + noff = 80*(j-1) + write (nf6out,3002) abitle(noff+1:noff+80) + write (nf6out,3003) devsigma, velsh + endif + enddo + + +c reset the spectrum plot boundaries before exiting + if(xlo .lt. xhi) then + call sm_limits (xlo,xhi,ylo,yhi) + iflip = 0 + else + call sm_limits (xhi,xlo,ylo,yhi) + iflip = 1 + endif +1000 return + + +c*****format statements +3001 format (/'RUN NUMBER:', i4, 65('-')) +3002 format (a80) +3003 format ('sigma =', f8.4, ' lambda shift =', f7.3, ' km/s') +3004 format ('del(Vr)=', f8.3, 5x, 'L1/L2=', f7.3) +3005 format ('sigma =',f8.4) + + + end + + + diff --git a/Binplotprep.f b/Binplotprep.f new file mode 100755 index 0000000..78c8ce5 --- /dev/null +++ b/Binplotprep.f @@ -0,0 +1,172 @@ + + subroutine binplotprep +c****************************************************************************** +c This routine concatenates two syntheses in order to make a smoothed +c binary synthetic spectrum +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Factor.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Equivs.com' + include 'Multistar.com' + real*8 normalization + integer pshift, pshiftabs + + +c*****open the files + nf7out = 21 + lscreen = 4 + array = 'RAW SYNTHESIS INPUT FOR PRIMARY' + nchars = 31 + call infile ('input ',nf7out,'formatted ',0,nchars, + . f7out,lscreen) + nf8out = 22 + lscreen = lscreen + 2 + array = 'RAW SYNTHESIS INPUT FOR SECONDARY' + nchars = 33 + call infile ('input ',nf8out,'formatted ',0,nchars, + . f8out,lscreen) + nf9out = 23 + lscreen = lscreen + 2 + array = 'RAW SYNTHESIS OUTPUT FOR COMBINED BINARY' + nchars = 40 + call infile ('output ',nf9out,'formatted ',0,nchars, + . f9out,lscreen) + if (plotopt .ne. 0) then + nf10out = 24 + lscreen = lscreen + 2 + array = 'SMOOTHED SYNTHESIS OUTPUT FOR COMBINED BINARY' + nchars = 45 + call infile ('output ',nf10out,'formatted ',0,nchars, + . f10out,lscreen) + nf5out = 26 + lscreen = lscreen + 2 + array = 'POSTSCRIPT PLOT OUTPUT FOR COMBINED BINARY' + nchars = 22 + call infile ('output ',nf5out,'formatted ',0,nchars, + . f5out,lscreen) + endif + if (plotopt .gt. 1) then + nf6out = 27 + lscreen = lscreen + 2 + array = 'SPECTRUM COMPARISON OUTPUT' + nchars = 27 + call infile ('output ',nf6out,'formatted ',0,nchars, + . f6out,lscreen) + endif + + +c*****compute and output the parameters related to the spectrum combination: +c the declared velocity difference, the luminosity ratio, and +c for information, the computed fluxes of the two stars; get the user's +c agreement + deltawave = deltaradvel/2.9979d+5*(start+sstop)/2. + pshift = nint(deltawave/step) + write (array,1002) fluxprimary, fluxsecondary + lscreen = lscreen + 2 + nchars = 55 + call putasci (nchars,lscreen) + write (array,1003) lumratio + lscreen = lscreen + 1 + nchars = 49 + call putasci (nchars,lscreen) + write (array,1001) deltaradvel, deltawave, pshift + lscreen = lscreen + 1 + nchars = 78 + call putasci (nchars,lscreen) + write (array,*) 'ARE THESE VALUES OK (y/n)? ' + lscreen = lscreen + 2 + nchars = 27 + + +c*****read back the header information from the individual star raw +c synthetic spectra +99 read (nf7out,1004,end=100) array + read (nf8out,1004) chinfo + if (array(1:7).eq.'Isotopi') then + write (nf9out,1004) array + go to 99 + elseif (array(1:7).eq.'ALL abu') then + write (nf9out,1010) array(1:59), chinfo(54:59) + go to 99 + elseif (array(1:7).eq.'Changin') then + write (nf9out,1011) array(1:37), chinfo(31:37) + go to 99 + elseif (array(1:7).eq.'element') then + write (nf9out,1012) array(1:30), chinfo(25:30) + go to 99 + elseif (array(1:7).eq.'MODEL: ') then + write (nf9out,1013) array(8:43), chinfo(8:43) + modbin(1) = array(1:80) + modbin(2) = chinfo(1:80) + endif + read (nf7out,1004) array + read (nf8out,1004) chinfo + read (array,*) start, sstop, step + kount = nint((sstop - start + (step/4.0) )/step) + 1 + write (nf9out,1004) array + + +c*****read back the raw synthetic spectra from the individual stars; +c shift by the appropriate point number, add the spectra (normalized), +c and dump to combined raw synthetic spectrum file + read (nf7out,1006) (y(i),i=1,kount) + read (nf8out,1006) (z(i),i=1,kount) + do i=1,kount + y(i) = 1.0 - y(i) + z(i) = (1.0 - z(i))/lumratio + enddo + normalization = 1.0 + 1.0/lumratio + if (pshift .gt. 0) then + do i=1,pshift + dev(i) = 1.0 + enddo + do i=pshift+1,kount + dev(i) = (y(i)+z(i-pshift))/normalization + enddo + elseif (pshift .eq. 0) then + do i=1,kount + dev(i) = (y(i)+z(i))/normalization + enddo + else + pshiftabs = iabs(pshift) + do i=1, kount-pshiftabs + dev(i) = (y(i)+z(i-pshift))/normalization + enddo + do i=kount-pshiftabs+1,kount + dev(i) = 1.0 + enddo + endif + do i=1,kount + y(i) = 1.0 - dev(i) + enddo + write (nf9out,1006) (y(i),i=1,kount) + go to 99 +100 return + + +c*****format statements +1001 format ('INPUT DELTA VELOCITY = ', f8.3, + . '; DELTA LAMBDA = ', f8.3, + . '; POINT SHIFT = ', i4) +1002 format ('PRIMARY FLUX = ', 1pe10.3, + . '; SECONDARY FLUX = ', 1pe10.3) +1003 format ('INPUT LUMINOSITY RATIO = ', 0pf8.3) +1004 format (a80) +1006 format (10f7.4) +1010 format (a59, ',', a6, ' dex') +1011 format (a37, ',', a6, ' dex') +1012 format (a30, ',', a6) +1013 format ('MODEL: ', 2a36) + + + end + + + + + + diff --git a/Blankstring.f b/Blankstring.f new file mode 100755 index 0000000..57cf62b --- /dev/null +++ b/Blankstring.f @@ -0,0 +1,18 @@ + +c*********************************************************************** + subroutine blankstring (string) +c*********************************************************************** +c this routine simply makes an 80-character string all blanks + + implicit real*8 (a-h,o-z) + character*80 string + + + do i=1,80 + string(i:i) = ' ' + enddo + return + + + end + diff --git a/Blends.f b/Blends.f new file mode 100755 index 0000000..5c886cf --- /dev/null +++ b/Blends.f @@ -0,0 +1,321 @@ + + subroutine blends +c****************************************************************************** +c This program does abundance derivations from blended spectral features; +c only one element will have its abundance derived per run. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Factor.com' + include 'Mol.com' + include 'Pstuff.com' + include 'Dummy.com' + + +c*****examine the parameter file + call params + + +c*****open the files for standard output and summary abundances + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = lscreen + 2 + array = 'SUMMARY ABUNDANCE OUTPUT' + nchars = 24 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + + +c*****open and read the model atmosphere + nfmodel = 30 + lscreen = lscreen + 2 + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****initialize some variables + isynth = 1 + isorun = 1 + iatom = nint(cogatom) + pec(iatom) = 1 + numpecatom = 1 + pecabund(iatom,1) = 0. + + +c*****open and read the line list file; get ready for the line calculations + nflines = 31 + lscreen = lscreen + 2 + array = 'THE LINE LIST' + nchars = 13 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) +100 call inlines (1) + call eqlib + call nearly (1) + + +c*****start the large loop that will go through each blended feature + ewsynthopt = -1 + mode = 4 +30 do lll=1,1000 + if (lim2line .eq. nlines) exit + + +c*****define the set of lines responsible for a blended feature + call linlimit + lim1 = lim1line + lim2 = lim2line + write (99,1007) iatom, wave1(lim1), wave1(lim2) + + +c*****make sure that the element whose abundance is to be fit has +c a representative line of the blend + ifind = 0 + do j=lim1,lim2 + if (atom1(j) .lt. 100.) then + if (iatom .eq. int(atom1(j))) then + ifind = 1 + exit + endif + else + call sunder (atom1(j),ia,ib) + if (iatom.eq.ia .or. iatom.eq.ib) then + ifind = 1 + exit + endif + endif + enddo + if (ifind .eq. 0) then + do j=lim1,lim2 + abundout(j) = 999.99 + enddo + write (nf1out,1002) + lim1line = lim2line + 1 + if (lim1line .le. nlines+nstrong) cycle + endif + + +c*****do the syntheses, forcing each abundance to predict the +c feature equivalent width; a limit of 30 iterations is imposed +c arbitrarily + ncurve = 1 + start = wave1(lim1) - delwave + sstop = wave1(lim2) + delwave + delta = wave1(lim2) - wave1(lim1) + delwave + oldstart = start + oldstop = sstop + oldstep = step + olddelta = delta + rwlgobs = dlog10(width(lim1)/wave1(lim1)) + gf1(ncurve) = 1. + do k=1,30 + call synspec + call total + error = (w(ncurve)-width(lim1))/width(lim1) + ratio = width(lim1)/w(ncurve) + ncurve = ncurve + 1 + + +c*****here we go for another iteration + if (dabs(error) .ge. 0.0075) then + rwlcomp = dlog10(w(ncurve-1)/wave1(lim1)) + if (rwlcomp.lt.-5.2 .and. rwlgobs.lt.-5.2) then + ratio = ratio + elseif (rwlcomp.ge.-5.2 .and. rwlgobs.ge.-5.2) then + ratio = ratio**2.0 + else + ratio = ratio**1.5 + endif + gf1(ncurve) = gf1(ncurve-1)*ratio + do j=lim1,lim2 + if (atom1(j) .gt. 100.) then + call sunder (atom1(j),ia,ib) + if (ia.eq.iatom .or. ib.eq.iatom) then + do i=1,ntau + kapnu0(j,i) = kapnu0(j,i)*ratio + enddo + endif + elseif (int(atom1(j)) .eq. iatom) then + do i=1,ntau + kapnu0(j,i) = kapnu0(j,i)*ratio + enddo + endif + enddo + if (k .eq. 20) then + write (*,1008) + stop + endif + else + exit + endif + enddo + + +c*****here we do the final calculation when the predicted and observed are close + gf1(ncurve) = gf1(ncurve-1)*ratio + do j=lim1,lim2 + if (atom1(j) .gt. 100.) then + call sunder (atom1(j),ia,ib) + if (ia.eq.iatom .or. ib.eq.iatom) then + do i=1,ntau + kapnu0(j,i) = kapnu0(j,i)*ratio + enddo + endif + elseif (int(atom1(j)) .eq. iatom) then + do i=1,ntau + kapnu0(j,i) = kapnu0(j,i)*ratio + enddo + endif + enddo + call synspec + call total + widout(lim1) = w(ncurve) + diff = dlog10(gf1(ncurve)) + abundout(lim1) = dlog10(xabund(iatom)) + 12.0 + diff + if (ncurve .ne. 1) then + write (nf1out,1001) ncurve + endif + + +c*****here is where some auxiliary things like mean depth are computed + if (lim1.eq.lim2 .and. linprintopt.ge.3) then + wave = wave1(lim1) + call taukap + call cdcalc(2) + first = 0.4343*cd(1) + d(1) = rinteg(xref,cd,dummy1,ntau,first) + do i=1,ntau + dummy1(i) = xref(i)*cd(i) + enddo + first = 0. + cdmean = rinteg(xref,dummy1,dummy2,ntau,first)/ + . rinteg(xref,cd,dummy2,ntau,first) + do i=1,ntau + if (cdmean .lt. cd(i)) exit + enddo + write (nf1out,1005) lim1, cdmean, i, xref(i) + do i=1,ntau + if (taunu(i)+taulam(i) .ge. 1.) exit + enddo + write (nf1out,1006) lim1, i, dlog10(tauref(i)), + . dlog10(taulam(i)), dlog10(taunu(i)) + endif + + +c*****assign the abundance to the strongest line of the blend that +c contains cogatom; put 999.99's as the abundances of all but +c this line; go back for another blended feature + if (lim2 .gt. lim1) then + abunblend = abundout(lim1) + widblend = widout(lim1) + strongest = 0. + linstrongest = 0 + do j=lim1,lim2 + abundout(j) = 999.99 + enddo + do j=lim1,lim2 + if (atom1(j) .lt. 100.) then + if (dint(atom1(j)) .eq. cogatom) then + if (kapnu0(j,jtau5) .gt. strongest) then + strongest = kapnu0(j,jtau5) + linstrongest = j + endif + endif + else + call sunder (atom1(j),ia,ib) + if (dble(ia).eq.cogatom .or. dble(ib).eq.cogatom) then + if (kapnu0(j,jtau5) .gt. strongest) then + strongest = kapnu0(j,jtau5) + linstrongest = j + endif + endif + endif + enddo + abundout(linstrongest) = abunblend + widout(linstrongest) = widblend + endif + lim1line = lim2line + 1 + if (lim1line .le. nlines+nstrong) cycle + enddo + + +c*****do abundance statistics; print out a summary of the abundances + lim1obs = 1 + lim2obs = nlines+nstrong + call stats + rewind nf2out + call lineinfo (3) + + +c*****here a plot may be made on the terminal (and paper) if there +c are enough lines; then the user will be prompted on some +c options concerning what is seen on the plot + if (plotopt .ne. 0) then + call pltabun + if (choice.eq.'v' .or. choice.eq.'m') go to 100 + endif + + +c*****now the option will be to redo the molecular equilibrium and redo +c the last species, at the user's option. + if (neq .ne. 0) then + do n=1,neq + if (iatom .eq. iorder(n)) then + write (array,1004) + ikount = min0(nlines+11,maxline) + nchars = 70 +35 call getasci (nchars,ikount) + choice = chinfo(1:1) + if (choice.eq.'y' .or. nchars.le.0) then + xabund(iatom) = 10.**(average-12.) + call eqlib + call nearly (1) + lim1line = 0 + lim2line = 0 + rewind nf2out + go to 30 + elseif (choice .eq. 'n') then + call finish (0) + else + go to 35 + endif + endif + enddo + endif + + +c*****exit the program + call finish (0) + + +c*****format statements +1001 format (' This fit required ',i2,' iterations'/) +1002 format ('WARNING: NO ELEMENT LINE TO VARY IN BLEND') +1004 format ('SPECIES USES MOLECULAR EQUILIBRIUM!', + . ' REDO WITH NEW ABUNDANCE ([y]/n)? ') +1005 format (/'LINE ', i5, ':', + . ' weighted mean line contribution function C_d =', + . f6.2/ ' which occurs near level ', i3, + . ' with log tauref = ', f6.2) +1006 format (/'LINE ', i5, ':', + . ' tau(total) is greater than 1 at level',i3/ + . ' logs of tauref, taulam, taunu =', 3f6.2) +1007 format (/'VARYING THIS ELEMENT: ', i8/ + . 'USING THE LINE GROUP IN THE RANGE: ', 2f10.3) +1008 format (' MAX OF 30 ITERATIONS REACHED; I QUIT!') + + + end + + + diff --git a/Bmolec.f b/Bmolec.f new file mode 100755 index 0000000..6a4cf81 --- /dev/null +++ b/Bmolec.f @@ -0,0 +1,226 @@ + + block data molec +c****************************************************************************** +c This routine contains the default list of molecules and ions used in the +c equilibrium calculations. This list includes species needed for +c continuous opacity and damping calculations in addition to the ions and +c molecules that have an affect of the partial pressures of the following: +c H, He, C, N, O, Mg, Al, Si, P, S, Cl, Ca, Ti, V, Cr, and Fe. The +c molecules in this list were selected based on predicted partial pressures +c for T > 3000 K. The cutoff was 1e-7 percent of the total gas pressure. +c The user is encouraged to check the completeness of this list for the +c physical conditions under consideration. +c +c This routine also contains the molecular equilibrium constant data for +c the most common diatomic and triatomic molecules. The equilibrium +c constants were calculated from the parital pressures in the Phoenix +c (NextGen) equation of state table on June 27, 2005. The data below are +c the coefficients for polynomial fits to the constants and span the range +c 1500 < T < 10000 K. The format is: molecule id, Do, coef(1:5) +c The constants are reconstructed by a polynomial expansion: +c log10(Kp) = sum{i=1:5}{coef(i)*log10(theta)**(i-1)} - Do*theta +c****************************************************************************** + implicit real*8 (a-h,o-z) + include 'Mol.com' + + +c*****Here is the default small list of ions and molecules; +c there are 30 of them +c P(H) = p(H) + p(H+) + 2p(H_2) + p(CH) + p(NH) + p(OH) + p(MgH) + 2p(H_2O) + p(HF) +c P(C) = p(C) + p(C+) + p(CH) + p(C_2) + p(CN) + p(CO) + p(CO_2) +c P(N) = p(N) + p(N+) + p(NH) + p(CN) + 2p(N_2) + p(NO) +c P(O) = p(O) + p(O+) + p(OH) + p(CO) + p(ON) + 2p(O_2) + 2p(CO_2) +c P(F) = p(F) + p(F+) + p(HF) +c P(Mg) = p(Mg) + p(Mg+) + p(MgH) + p(MgO) +c P(Al) = p(Al) + p(Al+) + p(AlH) + p(AlOH) +c P(Si) = p(Si) + p(Si+) + p(SiH) + p(SiO) +c P(Ti) = p(Ti) + p(Ti+) + p(TiH) + p(TiO) +c p(Fe) = p(Fe) + p(Fe+) + p(FeH) + p(FeO) + data (smallmollist(i),i=1,110)/ + . 1.1, 2.1, 6.1, 7.1, 8.1, 9.1, + . 12.1, 13.1, 14.1, 22.1, 26.1, 101.0, + . 106.0, 107.0, 108.0, 109.0, 112.0, 113.0, + . 114.0, 126.0, 606.0, 607.0, 608.0, 707.0, + . 708.0, 808.0, 10108.0, 60808.0, 812.0, 822.0, + . 80*0.0/ +c data (smallmollist(i),i=1,110)/ +c . 1.1, 6.1, 7.1, 8.1, 101.0, 106.0, +c . 107.0, 108.0, 606.0, 607.0, 608.0, 707.0, +c . 708.0, 808.0, 10108.0, 60808.0, +c . 94*0.0/ + + +c*****Here is the default large list of ions and molecules; +c there are 59 of them +c P(H) = p(H) + p(H+) + 2p(H_2) + p(CH) + p(NH) + p(OH) + p(MgH) + p(AlH) +c + p(SiH) + p(PH) + p(SH) + p(ClH) + p(CaH) + p(CrH) +c + p(FeH) + 2p(CH_2) + 2p(NH_2) + 2p(H_2O) + 2p(PH_2) +c + 2p(SH_2) + p(HCO) + p(MgOH) + p(AlOH) + p(CaOH) + p(HF) +c P(He) = p(He) + p(He+) +c P(C) = p(C) + p(C+) + p(CO) + p(CH) + 2p(CH_2) + p(HCO) + p(CN) +c + p(CS) + p(CO_2) +c P(N) = p(N) + p(N+) + 2p(N_2) + p(NH) + p(NH_2) + p(CN) + p(NO) +c + p(SiO) + p(PN) + p(SN) +c P(O) = p(O) + p(O+) + p(CO) + p(OH) + p(H_2O) + p(HCO) + p(MgOH) +c + p(AlOH) + p(CaOH) + 2p(CO_2) + p(NO) + 2p(O_2) +c + p(MgO) + p(SiO) + p(PO) + p(SO) + p(TiO) + p(VO) + p(FeO) +c P(F) = p(F) + p(F+) + p(HF) +c P(Mg) = p(Mg) + p(Mg+) + p(MgH) + p(MGOH) + p(MgO) +c P(Al) = p(Al) + p(Al+) + p(AlH) + p(AlOH) +c P(Si) = p(Si) + p(Si+) + p(SiH) + p(SiO) + p(SiS) +c P(P) = p(P) + p(P+) + p(PH) + p(PH_2) + p(PN) + p(PO) +c P(S) = p(S) + p(S+) + p(SH) + p(SH_2) + p(SC) + p(SN) + P(SO) + p(SiS) +c P(Cl) = p(Cl) + p(Cl+) + p(ClH) +c P(Ca) = p(Ca) + P(Ca+) + p(CaH) + p(CaO) +c P(Ti) = p(Ti) + p(Ti+) + p(TiH) + p(TiO) +c P(V) = p(V) + p(V+) + p(VO) +c P(Cr) = p(Cr) + p(Cr+) + p(CrH) +c p(Fe) = p(Fe) + p(Fe+) + p(FeH) + p(FeO) + data (largemollist(i),i=1,110)/ + . 1.1, 2.1, 6.1, 7.1, 8.1, 9.1, + . 12.1, 13.1, 14.1, 15.1, 16.1, 17.1, + . 20.1, 22.1, 23.1, 24.1, 26.1, + . 101.0, 106.0, 107.0, 108.0, 109.0, 112.0, + . 113.0, 114.0, 115.0, 116.0, 117.0, 120.0, + . 124.0, 126.0, 10106.0, 10107.0, 10108.0, 10115.0, + . 10116.0, 10608.0, 10812.0, 10813.0, 10820.0, 606.0, + . 607.0, 608.0, 616.0, 60808.0, 707.0, 708.0, + . 714.0, 715.0, 716.0, 808.0, 812.0, 814.0, + . 815.0, 816.0, 822.0, 823.0, 826.0, 1416.0, + . 51*0.0/ + +c*****Here are polynomial coefficients to match the partition functions +c for H_2O and CO_2 that are found at the HITRAN site: +c https://hitran.org/data/Q/q1.txt and https://hitran.org/data/Q/q7.txt +c These are expressed as simple polynomials or the form: +c u(T) = c(1)*T^0 + c(2)*T^1 + c(3)*T^2 + c(4)*T^3 + c(5)*T^4 + data (h2ocoeff(i),i=1,5)/ 2.01999d+00, 1.36468d-03, + . -3.70508d-07, 6.74255d-11, -4.94970d-15/ + data (co2coeff(i),i=1,5)/ 2.00071d+00, 1.79927d-03, + . -4.06396d-07, 6.00864d-11, -3.84741d-15/ + + + data ((datmol(i,j),i=1,7),j=1,10)/ + 1 101.0, 4.4781,12.1174, -1.0476, 1.6851, -5.5831, 4.0060, + 2 106.0, 3.4650,11.5335, -0.5211, -0.7475, 0.1494, -0.1967, + 3 107.0, 3.4700,11.4657, -0.7265, -0.6439, 0.0004, 0.1269, + 4 108.0, 4.3920,11.8018, -0.8525, -0.5525, 0.1625, -0.1935, + 5 109.0, 5.8690,12.2897, -0.9174, -0.6416, 0.1616, -0.1222, + 6 111.0, 1.8800,10.7189, -0.8053, 4.1674,-12.8321, 10.8590, + 7 112.0, 1.3400,10.2878, -0.3455, 0.1677, -3.8628, 4.7348, + 8 113.0, 3.0600,11.4876, -0.4024, -0.4809, -1.6283, 2.5415, + 9 114.0, 3.0600,11.2586, -0.6758, -0.5870, 0.0669, 0.3139, + * 115.0, 3.3000,11.3387, -0.2112, 0.5964, 0.2027, 0.2323/ + data ((datmol(i,j),i=1,7),j=11,20)/ + 1 116.0, 3.5500,11.4380, -0.7731, -0.4785, 0.1716, -0.2326, + 2 117.0, 4.4336,11.9042, -0.8250, -0.6309, 0.1545, -0.1999, + 3 120.0, 1.7000,10.1987, -0.9426, 1.8085, -4.6629, 3.4971, + 4 124.0, 2.1700,10.4501, -3.4047, -2.5032, 1.6933, -2.1073, + 5 125.0, 1.3100, 9.7219, -3.9379, -3.4116, 0.6378, -3.0173, + 6 126.0, 2.4100,12.1214, 0.9531, 2.3351, -0.2231, 3.0718, + 7 128.0, 2.7000,11.9592, -0.9476, -0.4685, 0.8228, 0.2487, + 8 129.0, 2.8400,11.3419, -1.3372, -0.6389, 1.5957, -0.4408, + 9 10106.0, 7.9400,23.8688, -1.7944, 4.4565,-10.8615, 6.6375, + * 10107.0, 7.4400,23.7463, -1.7687, 4.2349,-12.2375, 8.6009/ + data ((datmol(i,j),i=1,7),j=21,30)/ + 1 10108.0, 9.6221,24.6063, -1.8370, 3.9590,-10.9331, 7.4896, + 2 10115.0, 6.4895,23.0957, -2.0802, 5.0222,-10.7703, 5.8343, + 3 10116.0, 7.5946,23.8619, -1.7009, 4.4792,-11.4475, 7.2724, + 4 10508.0,12.7425,25.2365, -1.2673, 5.1472,-12.0672, 7.6325, + 5 10607.0,13.2363,25.1400, -1.3548, 5.4650,-12.6262, 7.5607, + 6 10608.0,11.8560,24.6494, -1.6665, 4.8174,-10.9079, 6.7311, + 7 10708.0, 8.6140,24.4465, -1.3261, -0.5924, 0.0156, -0.7950, + 8 10811.0, 8.0150,23.3475, -1.4238, 7.1752,-17.8186, 13.4471, + 9 10812.0, 8.0735,23.3316, -1.3691, 6.1267,-15.3175, 11.1568, + * 10813.0,10.1252,25.2641, -1.4342, 5.1091,-13.2682, 9.2414/ + data ((datmol(i,j),i=1,7),j=31,40)/ + 1 10819.0, 8.1892,23.3235, -1.9306, 8.6260,-17.6081, 10.5153, + 2 10820.0, 8.7035,23.2006, -1.9644, 8.3448,-17.4669, 10.8898, + 3 10856.0, 9.0621,23.3508, -2.9133, 7.9864,-14.7824, 10.4060, + 4 508.0, 8.2800,12.6247, -0.6958, -0.4147, 0.2800, -0.4535, + 5 606.0, 6.2100,12.4677, -0.4434, -0.0516, -0.1304, -0.0555, + 6 607.0, 7.7600,12.4439, -0.4823, -0.4724, -1.1721, 1.3124, + 7 608.0,11.0920,13.2412, -0.8502, -0.0724, -0.2098, -0.2096, + 8 614.0, 4.6400,11.8943, -1.2037, 2.5280, -5.4728, 3.5183, + 9 615.0, 6.8950,13.0550, 1.1581, 2.9371, 0.6616, 1.9298, + * 616.0, 7.3550,12.8508, -0.7689, -0.4254, 1.9738, -2.7599/ + data ((datmol(i,j),i=1,7),j=41,50)/ + 1 60606.0,13.8610,26.3157, -1.9852, 4.7933,-10.1191, 6.4350, + 2 60614.0,13.1966,25.7482, -0.8673, 6.1588,-14.8609, 10.8245, + 3 60717.0,12.2076,25.3546, -0.9498, 6.1809,-13.9272, 8.7748, + 4 60808.0,16.5382,26.9665, -1.5802, 5.2319,-12.8507, 7.2799, + 5 61616.0,11.9993,26.2469, -1.0515, 6.3688,-12.9191, 7.5525, + 6 707.0, 9.7594,12.8868, -0.8861, 0.2644, -1.4001, 0.9645, + 7 708.0, 6.4968,11.9347, -0.7631, 0.0848, -0.8149, 0.4636, + 8 709.0, 2.8190,11.4441, -1.2536, -0.9028, -0.5407, -0.8453, + 9 714.0, 4.5100,11.9190, -0.7171, -0.7889, -1.6147, 1.2567, + * 715.0, 7.1110,12.1020, -1.2837, 0.4612, -1.4609, 0.1464/ + data ((datmol(i,j),i=1,7),j=51,60)/ + 1 716.0, 4.8000,11.9264, -1.0597, 2.7095, -6.0355, 3.6858, + 2 70708.0,11.4400,25.8228, -1.8022, 5.4142,-13.7572, 7.8651, + 3 70808.0, 9.6210,25.4890, -2.1013, 4.7855,-12.0992, 6.7146, + 4 808.0, 5.1156,12.8763, -0.4923, -0.5474, 0.2097, -0.3337, + 5 811.0, 3.0790,11.1443, 0.1006, 1.3407, -0.8726, 1.1604, + 6 812.0, 3.5300,10.7965, -0.4336, 4.5543, -9.6555, 6.8587, + 7 813.0, 5.2700,12.2111, -0.5018, -0.0903, -1.3613, 1.7974, + 8 814.0, 8.2600,12.9276, -0.7698, -0.5315, 2.1774, -2.8482, + 9 815.0, 6.0710,11.9149, -1.0730, 0.4169, -0.8595, -0.0207, + * 816.0, 5.3590,12.3424, -0.8964, 2.5742, -6.2111, 3.7515/ + data ((datmol(i,j),i=1,7),j=61,70)/ + 1 817.0, 2.7450,11.8129, -1.0573, 2.2239, -5.7356, 3.2844, + 2 820.0, 4.5310,11.7806, 1.6875, 3.1813, -5.1106, 4.8826, + 3 821.0, 6.9600,12.5239, -1.2329, 1.5239, -1.9903, 0.4735, + 4 822.0, 6.8700,12.3189, -1.8737, 4.2408, -7.4936, 3.3890, + 5 823.0, 6.4100,12.8103, -0.5642, -0.5910, -2.5261, 3.9417, + 6 826.0, 4.2000,12.5333, -1.0582, 1.0158, -1.5253, 0.7221, + 7 839.0, 7.2900,12.4455, -1.3319, 1.0692, 0.0949, -2.0131, + 8 840.0, 7.8500,12.4688, -1.0832, 0.0935, -0.2133, 0.5480, + 9 856.0, 5.4410,11.5981, -2.2831, -1.3418, 4.2093, -4.0635, + * 857.0, 8.2300,12.1926, 0.1654, -0.8084, -1.0001, 1.1994/ + data ((datmol(i,j),i=1,7),j=71,80)/ + 1 80814.0,13.0355,26.5705, -1.1245, 6.0979,-12.6131, 7.8414, + 2 80816.0,11.1405,25.9338, -1.3799, 5.5465,-11.7480, 7.0670, + 3 80822.0,13.2915,25.9435, -2.1804, 7.1450,-13.0296, 7.9278, + 4 80839.0,15.2000,25.8616, -1.4066, -0.5348, 2.4526, -1.0943, + 5 80840.0,14.4650,25.6438, -2.2794, 6.4569,-11.9176, 7.3456, + 6 80857.0,21.1510,31.0796, 10.7083, 13.0309, 9.1626, 10.4251, + 7 81313.0,10.9653,24.8867, -0.8364, 6.6875,-15.6083, 11.6178, + 8 909.0, 1.5920,12.6197, -0.4363, -0.5840, 0.4907, -0.6261, + 9 911.0, 4.9530,11.4755, -0.4941, 0.6264, -1.1793, 0.5988, + * 912.0, 3.2000, 9.4953, -4.2045, -4.0612, -3.2308, -3.0520/ + data ((datmol(i,j),i=1,7),j=81,90)/ + 1 913.0, 6.8900,12.2405, -0.4662, -0.3499, -0.6568, 1.0680, + 2 914.0, 5.5700,12.0156, -0.5029, -0.1059, 0.3137, 0.0030, + 3 916.0, 3.3380,11.6730, -0.9068, -0.8140, -0.0380, -0.8173, + 4 917.0, 2.6160,12.2059, 0.4295, -3.9612, 6.8690, -4.3459, + 5 1111.0, 0.7300,10.2142, -0.5498, 1.0576, -2.8013, 1.4272, + 6 1117.0, 4.2300,11.0824, -0.4354, 1.4015, -6.7895, 7.3949, + 7 1216.0, 2.4000,11.3114, -0.5242, 0.5655, -3.1955, 3.8100, + 8 1217.0, 2.7010,10.2253, -1.7707, -1.1903, -1.3832, -0.9560, + 9 1313.0, 1.5500,11.3645, -0.1608, 0.1321, -3.2955, 4.3483, + * 1316.0, 3.8400,11.9118, -0.4891, -0.0108, -1.2859, 1.7739/ + data ((datmol(i,j),i=1,7),j=91,100)/ + 1 1317.0, 5.1200,11.8263, -0.3140, -1.0244, 0.8982, -0.1197, + 2 1414.0, 3.2100,12.1806, -0.6731, -0.1732, 0.0349, 0.4326, + 3 1416.0, 6.4200,12.6372, -0.7285, -0.0244, 0.8566, -1.1574, + 4 1417.0, 4.0020,11.7232, -0.2951, 0.1824, 0.8534, -0.3405, + 5 1515.0, 5.0330,12.2546, -1.1717, 1.4643, -1.9459, 0.8396, + 6 1516.0, 5.6370,12.5482, 1.4333, 3.0823, 0.9032, 2.0434, + 7 1616.0, 4.3693,12.3238, -0.9114, 2.7995, -6.1180, 3.5118, + 8 1617.0, 2.7490,11.8411, -0.0001, 0.5709, 0.7753, 0.0580, + 9 1622.0, 4.7500,11.6639, -1.3994, 1.3016, -1.2659, 0.5035, + * 1717.0, 2.4760,12.2664, -0.5351, -0.6211, 0.7092, -0.7675/ + data ((datmol(i,j),i=1,7),j=101,110)/ + 1 2016.0, 3.4600,10.8548, 0.2371, 3.1884, -8.1647, 5.1342, + 2 2616.0, 3.1000,11.3327, -1.5519, 0.5150, -1.5570, -0.0107, + 3 56*0.0/ + + end + + + + + + + + @@ -0,0 +1,59 @@ + + subroutine boxit +c****************************************************************************** +c This subroutine figures out the point numbers of the wavelength +c boundaries for synthetic spectrum plots +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Pstuff.com' + include 'Linex.com' + include 'Equivs.com' + + +c*****if only a synthetic spectrum is being plotted, use beginning and +c end points of the synthetic spectrum instead of those of the observed +c spectrum + if (plotopt .lt. 2) then + do i=1,kount + if (xlo .le. xsyn(i)) then + lim1obs = i + go to 10 + endif + enddo + lim1obs = kount +10 do i=lim1obs,kount + if (xhi .lt. xsyn(i)) then + lim2obs = i -1 + return + endif + enddo + lim2obs = kount + return + + +c*****and here is the same logic when an observed spectrum exists + else + do i=1,lount + if (xlo .le. xobs(i)) then + lim1obs = i + go to 20 + endif + enddo + lim1obs = lount +20 do i=lim1obs,lount + if (xhi .lt. xobs(i)) then + lim2obs = i -1 + return + endif + enddo + lim2obs = lount + return + endif + + end + + + + diff --git a/Calmod.f b/Calmod.f new file mode 100755 index 0000000..3938bef --- /dev/null +++ b/Calmod.f @@ -0,0 +1,49 @@ + + subroutine calmod +c****************************************************************************** +c this program re-calculates BEGN models on a tau5000 scale. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Pstuff.com' + + +c*****open the files for standard output and the re-calculated model + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = lscreen + 2 + array = 'RE-CALCULATED MODEL OUTPUT' + nchars = 26 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + + +c*****open and read the model atmosphere + nfmodel = 30 + lscreen = lscreen + 2 + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****do the tau scale conversion + call opacit(2,wavref) + write (nf2out,1001) wavref,(taulam(i),t(i),pgas(i), + . ne(i),kaplam(i),i=1,ntau) + return + + +c*****format statements +1001 format ('output model for wavelength = ',f5.0/ + . (1pe11.4,0pf7.0,1p3e11.4)) + + + end diff --git a/Cdcalc.f b/Cdcalc.f new file mode 100755 index 0000000..825785c --- /dev/null +++ b/Cdcalc.f @@ -0,0 +1,52 @@ + + subroutine cdcalc (number) +c****************************************************************************** +c this routine calculates continuum and line+continuum +c contribution functions +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + +c*****continuum "contribution curve" calculation + if (number .eq. 1) then + do i=1,ntau + scont(i) = ((1.19089d+25/wave**2)*1.0d+10)/(wave**3* + . (dexp(1.43879d+08/(wave*t(i)))-1.0d+00)) + if (fluxintopt .eq. 1) then + cd(i) = kaplam(i)*tauref(i)*scont(i)* + . dexp(-taulam(i))/(0.4343*kapref(i)) + else + cd(i) = 2.0*kaplam(i)*tauref(i)*scont(i)* + . expint(taulam(i),2)/(0.4343*kapref(i)) + endif + enddo + +c*****line plus continuum "contribution curve" calculation + else + do i=1,ntau + sline(i) = scont(i) + if (fluxintopt .eq. 1) then + if (taulam(i)+taunu(i) .le. 50.) then + exptau = dexp(-taulam(i)-taunu(i)) + else + exptau = 0. + endif + cd(i) = tauref(i)*kaplam(i)/(0.4343*flux* + . kapref(i))*(scont(i)*dexp(-taulam(i)) - + . (1.0+kapnu(i)/kaplam(i))*sline(i)*exptau) + else + cd(i) = 2.0*tauref(i)*kaplam(i)/(0.4343*flux* + . kapref(i))*(scont(i)*expint(taulam(i),2) - + . (1.0+kapnu(i)/kaplam(i))*sline(i)* + . expint(taulam(i)+taunu(i),2)) + endif + enddo + endif + +c*****normal exit + return + + + end diff --git a/Chabund.f b/Chabund.f new file mode 100755 index 0000000..49f279c --- /dev/null +++ b/Chabund.f @@ -0,0 +1,253 @@ + + subroutine chabund +c***************************************************************************** +c this routine changes the input abundances according to the users request +c and the re-runs the synthesis with the new abundances OVERWRITING the +c original output files, but using the same model, linelist, etc +c***************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Factor.com' + include 'Mol.com' + include 'Pstuff.com' + include 'Multistar.com' + real*8 xnum + real*4 shortnum + character choice2 + + +c*****set the local temporary parameters to what they were for the last synth + newnumiso = numiso + newnumisosyn = numisosyn + newnumpecatom = numpecatom + newnumatomsyn = numatomsyn + if (newnumatomsyn .eq. 0) newnumatomsyn = 1 + do i=3,95 + newpec(i) = pec(i) + do j=1,newnumatomsyn + newpecabund(i,j) = pecabund(i,j) + enddo + enddo + do i=1,newnumiso + if(newnumiso .ge. 1) then + newisotope(i)=isotope(i) + do j=1,newnumisosyn + newisoabund(i,j)=isoabund(i,j) + enddo + endif + enddo + if (newnumatomsyn .le. 0) newnumatomsyn = 1 + + +c*****SPECIAL CASE +c for the "binary" driver, present a limited set of options; only +c the abundances of the elements already chosen for variation in +c the parameter file can be altered +11 if (control .eq. 'binary ') then + istat = ivcleof(4,1) + if (syncount .eq. 1) then + array = 'Abundance Alterations for the PRIMARY STAR: ' + else + array = 'Abundance Alterations for the SECONDARY STAR: ' + endif + istat = ivwrite(5,5,array,46) + array = 'Atom Abundance (relative to initial model)' + istat = ivwrite(6,1,array,49) + line = 6 + do i=3,95 + if(newpec(i) .eq. 1) then + line = line + 1 + write (array,1001) i,(newpecabund(i,j),j=1,newnumatomsyn) + istat = ivwrite(line,1,array,57) + endif + enddo + array = 'Options: c = change abundances ' + istat = ivwrite(line+1,1,array,41) + array = ' x = exit no changes q = rerun synth' + istat = ivwrite(line+2,1,array,47) + array = 'What is your choice? ' + nchars = 21 + call getasci (nchars,line+4) + choice = chinfo(1:1) + if (choice.ne.'c' .and. choice.ne.'x' .and. + . choice.ne.'q') go to 11 + endif + + +c*****for the "synth" driver, present the user with the current abundance +c alterations, and the options; find out what is desired +1 if (control .eq. 'synth' .or. + . control .eq. 'isotop' .or. + . control .eq. 'synpop') then + line = 4 + istat = ivcleof(line,1) + write (array,1006) + line = line + 1 + istat = ivwrite(6,1,array,72) + line = line + 1 + do i=3,95 + if(newpec(i) .eq. 1) then + line = line + 1 + write (array,1001) i,(newpecabund(i,j),j=1,newnumatomsyn) + istat = ivwrite(line,1,array,57) + endif + enddo + if (newnumiso .gt. 0) then + do i=1,newnumiso + line = line + 1 + write (array,1002) i, newisotope(i), + . (newisoabund(i,j),j=1,newnumisosyn) + istat = ivwrite(line,1,array,68) + enddo + endif + write (array,1007) + istat = ivwrite(line+1,1,array,61) + write (array,1008) + istat = ivwrite(line+2,1,array,72) + array = 'What is your choice? ' + nchars = 21 + call getasci (nchars,line+3) + choice = chinfo(1:1) + if (choice.ne.'c' .and. choice.ne.'i' .and. + . choice.ne.'n' .and. choice.ne.'x' .and. + . choice.ne.'q') go to 1 + endif + + +c*****for "synth", change elemental abundances + if (choice .eq. 'c') then +20 istat = ivcleof(line+1,1) + array = 'Which element to change? ' + nchars = 25 + call getnum (nchars,line+1,xnum,shortnum) + if (xnum.lt.2.0 .or. xnum.gt.95.) go to 20 + j = nint(xnum) + if (newpec(j) .eq. 1) then +25 array = 'n = new abundances, or z = zero offsets? ' + nchars = 41 + call getasci (nchars,line+2) + choice2 = chinfo(1:1) + if (choice2 .eq. 'z') then + newpec(j) = 0 + do i=1,5 + newpecabund(j,i) = 0.0 + enddo + newnumpecatom = newnumpecatom - 1 + elseif (choice2 .eq. 'n') then + write (array,1004) + istat = ivwrite(line+3,1,array,40) + read (*,*) (newpecabund(j,i),i=1,newnumatomsyn) + else + go to 25 + endif + else + newpec(j) = 1 + write (array,1004) + istat = ivwrite(line+2,1,array,40) + read (*,*) (newpecabund(j,i),i=1,newnumatomsyn) + newnumpecatom = newnumpecatom + 1 + endif + + +c*****for "synth", change isotopic factors + elseif (choice .eq. 'i') then + istat = ivcleof(line+1,1) + array = 'Options: c = change an isotopic factor' + istat = ivwrite(line+1,1,array,49) + array = ' n = enter a new isotope' + istat = ivwrite(line+2,1,array,48) +30 array = 'What is your choice? ' + nchars = 22 + call getasci (nchars,line+3) + choice2 = chinfo(1:1) + if (choice2 .eq. 'c') then +35 istat = ivcleof(line+1,1) + array = 'Which isotope number from the list? ' + nchars = 36 + call getnum (nchars,line+1,xnum,shortnum) + j = nint(xnum) + if (j.lt.1 .or. j.gt.newnumiso) go to 35 + istat = ivcleof(line+2,1) + array = 'What are the new division factors? ' + istat = ivwrite(line+2,1,array,35) + read (*,*) (newisoabund(j,i),i=1,newnumisosyn) + elseif (choice2 .eq. 'n') then + newnumiso = newnumiso + 1 + istat = ivcleof(line+1,1) + array = 'What is the new isotope designation? ' + nchars = 37 + call getnum (nchars,line+4,xnum,shortnum) + newisotope(newnumiso) = xnum + array = 'What are its division factors? ' + istat = ivwrite(line+2,1,array,31) + read (*,*) (newisoabund(newnumiso,i),i=1,newnumisosyn) + else + go to 30 + endif + + +c*****for "synth", change the number of syntheses + elseif (choice .eq. 'n') then +55 array = 'How many synths? ' + nchars = 17 + call getnum (nchars,line+5,xnum,shortnum) + if (xnum .gt. 5.) go to 55 + newnumatomsyn = nint(xnum) + go to 1 + + +c*****for "synth", exit the routine without changing anything + elseif (choice .eq. 'x') then + return + + +c*****for "synth", make the proposed alterations permanent; then +c return to the calling routine, which allegedly will +c redo the syntheses. + elseif (choice .eq. 'q') then + numiso = newnumiso + numisosyn = newnumisosyn + numpecatom = newnumpecatom + numatomsyn = newnumatomsyn + do i=3,95 + pec(i) = newpec(i) + do j=1,numatomsyn + pecabund(i,j) = newpecabund(i,j) + enddo + enddo + do i=1,numiso + if(numiso .ge. 1) then + isotope(i) = newisotope(i) + do j=1,numisosyn + isoabund(i,j)=newisoabund(i,j) + enddo + endif + enddo + return + endif + + +c*****loop back and print out the main menu again + if (control .eq. 'synth ') then + go to 1 + else + go to 11 + endif + + +c*****format statements +1001 format (i3, 4x, 5(f8.3, 2x)) +1002 format (i2, 2x, f10.5, 5(3x, f8.3)) +1004 format ('Enter the new offsets on the line below:') +1006 format ('element, abundance offsets OR ', + . 'isotope number, isotope name, factors') +1007 format ('Options: c = change abundance ', + . 'i = change isotopic ratio') +1008 format(' n = change # syntheses q = rerun ', + . 'syntheses x = exit') + + end + + + @@ -0,0 +1,106 @@ + + subroutine cog +c****************************************************************************** +c This routine produces sets of curves-of-growth +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + + +c*****examine the parameter file + call params + + +c*****open the files for standard output and summary curves-of-growth + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = lscreen + 2 + array = 'SUMMARY C-O-G OUTPUT' + nchars = 20 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + nf5out = 26 + lscreen = lscreen + 2 + array = 'POSTSCRIPT PLOT OUTPUT' + nchars = 22 + call infile ('output ',nf5out,'formatted ',0,nchars, + . f5out,lscreen) + + +c*****open and read the model atmosphere + array = 'THE MODEL ATMOSPHERE' + nchars = 20 +102 nfmodel = 30 + lscreen = lscreen + 2 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****open and read the line list file; get ready for the line calculations + nflines = 31 + lscreen = lscreen + 2 + array = 'THE LINE LIST' + nchars = 13 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + isynth = 1 +101 call inlines (1) + call eqlib + call nearly (1) + + +c*****define the range of lines (the whole list, in this case) + mode = 1 + call linlimit + if (lim1line .lt. 0) then + call finish (0) + return + endif + + +c*****do the curves of growth, making plots if desired + do lim1=lim1line,lim2line + lim2 = lim1 + call curve + call pltcog + if (choice .eq. 'm') then + close (unit=nfmodel) + close (unit=nflines) + rewind nf1out + rewind nf2out + rewind nf5out + array = 'THE NEW MODEL ATMOSPHERE' + nchars = 24 + fmodel = 'no_filename_given' + go to 102 + endif + if (choice .eq. 'v') go to 101 + array = 'DO ANOTHER CURVE-OF-GROWTH ([y]/n)? ' + nchars = 36 + lscreen = 16 + call getasci (nchars,lscreen) + choice = chinfo(1:1) + if (choice .eq. 'n') then + call finish (0) + return + endif + enddo + + +c****end the computations + call finish (0) + return + + + end + + diff --git a/Cogplot.f b/Cogplot.f new file mode 100755 index 0000000..ee2d5bf --- /dev/null +++ b/Cogplot.f @@ -0,0 +1,123 @@ + + subroutine cogplot +c****************************************************************************** +c This subroutine creates plots of curves-of-growth +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Pstuff.com' + real*4 gfplot(3000), rwplot(3000) + real*4 xfour, style(1) + character*4 ion + + +c*****dump the data into working arrays + do i=1,ncurve + gfplot(i) = gf1(i) + rwplot(i) = w(i) + enddo + + +c*****define the plot boundaries + ylo = real(nint(rwlow*10))/10. - 0.1 + yhi = real(nint(rwhigh*10))/10. + 0.1 + do i=1,ncurve + if (rwplot(i) .gt. rwlow) then + if (gfplot(i) .gt. 0) then + xlo = real(int(gfplot(i)*10))/10 + else + xlo = real(int(gfplot(i)*10))/10 - 0.1 + endif + go to 10 + endif + enddo +10 do i=1,ncurve + if (rwplot(i) .gt. rwhigh) then + if (gfplot(i) .gt. 0) then + xhi = real(int(gfplot(i)*10))/10 + 0.1 + else + xhi = real(int(gfplot(i)*10))/10 + endif + endif + enddo + + +c*****start the plot via some setup calls + call sm_limits (xlo,xhi,ylo,yhi) + smlxtic = 0.20 + smlytic = 0.20 + bigxtic = 1.0 + bigytic = 1.0 + call sm_ticksize (smlxtic,bigxtic,smlytic,bigytic) + + +c*****draw and label the box for the curve-of-growth + call sm_expand (0.6) + call sm_lweight (1.4) + call defcolor (1) + call sm_box (0,0,0,0) + call sm_expand (0.85) + call sm_box (1,2,4,4) + array = 'log gf' + call sm_relocate (0.5*(xlo+xhi),ylo-0.10*(yhi-ylo)) + call sm_putlabel (5,array) + array = 'log (EW/lambda)' + call sm_relocate (xlo-0.06*(xhi-xlo),0.5*(yhi+ylo)) + call sm_angle (90.) + call sm_putlabel (5,array) + call sm_angle (0.) + call sm_ltype (1) + call sm_lweight (0.8) + call sm_grid (0,0) + call sm_ltype (0) + + +c*****plot the computed curve-of-growth points; exit normally + call sm_expand (1.05) + call defcolor (2) + style(1) = 240.7 + call sm_ptype (style,1) + call sm_points (gfplot,rwplot,ncurve) + call defcolor (1) + ich = idint(charge(lim1) + 0.1) + if (ich .eq. 1) then + ion = ' I ' + elseif (ich .eq. 2) then + ion = ' II ' + elseif (ich .eq. 3) then + ion = ' III' + endif + iatom = idint(atom1(lim1)) + write (array,1002) names(iatom),ion + call sm_expand (0.75) + call sm_relocate (xhi-0.20*(xhi-xlo),ylo+0.35*(yhi-ylo)) + call sm_putlabel (5,array) + call sm_relocate ((xhi+xlo)/2.0,yhi-0.03*(yhi-ylo)) + call sm_putlabel (5,moditle) + xfour = dlog10(xabund(iatom)) + 12.0 + write (array,1003) xfour + call sm_relocate (xhi-0.20*(xhi-xlo),ylo+0.27*(yhi-ylo)) + call sm_putlabel (5,array) + write (array,1005) wave1(lim1) + call sm_relocate (xhi-0.20*(xhi-xlo),ylo+0.19*(yhi-ylo)) + call sm_putlabel (5,array) + write (array,1004) e(lim1,1) + call sm_relocate (xhi-0.20*(xhi-xlo),ylo+0.11*(yhi-ylo)) + call sm_putlabel (5,array) + return + + +c*****format statements +1002 format (a2,a4) +1003 format ('log eps =',f7.3) +1004 format ('E.P. (eV) =',f7.3) +1005 format ('lambda (A) =',f11.3) + + end + + + + diff --git a/Cogsyn.f b/Cogsyn.f new file mode 100755 index 0000000..b16de64 --- /dev/null +++ b/Cogsyn.f @@ -0,0 +1,102 @@ + + subroutine cogsyn +c****************************************************************************** +c This program produces a curve-of-growth of a blended feature, +c altering only a specified species' abundance. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Factor.com' + include 'Mol.com' + include 'Pstuff.com' + + +c*****examine the parameter file + call params + + +c*****open the files for standard output and summary curves-of-growth + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = lscreen + 2 + array = 'SUMMARY C-O-G OUTPUT' + nchars = 20 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + + +c*****open and read the model atmosphere + nfmodel = 30 + lscreen = lscreen + 2 + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****open and read the line list file; get ready for the line calculations + nflines = 31 + lscreen = lscreen + 2 + array = 'THE LINE LIST' + nchars = 13 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + call inlines (1) + call eqlib + call nearly (1) + + +c*****do the syntheses + isynth = 1 + isorun = 1 + ncurve = 0 + iatom =nint(cogatom) + pec(iatom) = 1 + numpecatom = 1 + pecabund(iatom,1) = 0. + mode = 3 +10 ncurve = ncurve + 1 + nlines = 0 + call synspec + call total + if (ncurve .eq. 1) then + wstart = 10.**(rwlow)*wave1(lim1) + wstop = 10.**(rwhigh)*wave1(lim1) + endif + molopt = 1 + linprintopt = 0 + if (w(ncurve) .gt. wstart) then + pecabund(iatom,1) = pecabund(iatom,1) - rwstep + go to 10 + endif + pecabund(iatom,1) = rwstep +20 ncurve = ncurve + 1 + nlines = 0 + call synspec + call total + molopt = 1 + linprintopt = 0 + if (w(ncurve) .lt. wstop) then + pecabund(iatom,1) = pecabund(iatom,1) + rwstep + go to 20 + endif + call pltcog + + +c*****finish + call finish (0) + end + + + + + + diff --git a/Correl.f b/Correl.f new file mode 100755 index 0000000..6742f52 --- /dev/null +++ b/Correl.f @@ -0,0 +1,140 @@ + + subroutine correl +c****************************************************************************** +c This routine cross-correlates arrays x and y using any part of the +c arrays, as long as there are enough data points in each array. +c The result is printed out in terms of the shift in the abscissa +c of the y array needed to align it with the x array. +c****************************************************************************** + + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Equivs.com' + include 'Plotval.com' + real*4 xgood(100000), ygood(100000), zgood(100000) + real*8 spx(1000), spy(1000) + real*4 q + real*8 xinterp(21), yinterp(21) + + + wavemin = amax1(xsyn(1),xobs(1)) + wavemax = amin1(xsyn(kount),xobs(lount)) + wavecenter = (wavemax + wavemin)/2. + + +c*****find the array subscripts for the minimum and maximum +c wavelengths in the synthetic spectrum. + do i=1,kount + if (xsyn(i) .ge. wavemin) then + ilosyn = i + go to 5 + endif + enddo +5 do i=ilosyn,kount + if (xsyn(i) .gt. wavemax) then + ihisyn = i - 1 + go to 10 + endif + enddo + ihisyn = kount + + +c*****dump the synthetic spectrum wavelengths and fluxes into working arrays +10 itotsyn = ihisyn - ilosyn + 1 + do i=1, itotsyn + xgood(i) = xsyn(ilosyn-1+i) + ygood(i) = chunk(ilosyn-1+i,1) + enddo + + +c*****find the array subscript for the minimum wavelength in the +c observed spectrum + do j=1,lount + if (xobs(j) .ge. xgood(1)) then + jloobs = j + go to 15 + endif + enddo + + +c*****using a 3-point Lagrangian, make an interpolated observed +c spectrum that matches the wavelength step size of the +c synthetic spectrum +15 j = jloobs + do i=1,itotsyn + if (xgood(i) .gt. (xobs(j+1)+xobs(j))/2.) j = j + 1 + q = xgood(i) + zgood(i) = yobs(j-1)*(q-xobs(j))*(q-xobs(j+1))/ + . ((xobs(j-1)-xobs(j))*(xobs(j-1)-xobs(j+1))) + + . yobs(j)*(q-xobs(j-1))*(q-xobs(j+1))/ + . ((xobs(j)-xobs(j-1))*(xobs(j)-xobs(j+1))) + + . yobs(j+1)*(q-xobs(j-1))*(q-xobs(j))/ + . ((xobs(j+1)-xobs(j-1))*(xobs(j+1)-xobs(j))) + enddo + + +c*****next, EITHER do a single cross-correlation + call crosscorr (ishift,spy(1),ygood,zgood,itotsyn) + +c*****next, do the cross-correlation: + imax = 2*maxshift + 1 + do i=1,imax + ishift = i - 1 - maxshift + spx(i) = dble(ishift) + call crosscorr (ishift,spy(i),ygood,zgood,itotsyn) + enddo + +c*****interpolate to find the maximum of the correlation function + corrmax = spy(1) + mc = 1 + do i=2,imax + if (spy(i) .gt. corrmax) then + corrmax = spy(i) + mc = i + endif + enddo + if (mc.eq.1 .or. mc.eq.imax) then + deltawave = 0. + return + endif + xinterp(1) = spx(mc-1) + yinterp(1) = spy(mc-1) + do j=2,21 + q = spx(mc-1) + (j-1)/10. + xinterp(j) = q + yinterp(j) = spy(mc-1)*(q-spx(mc))*(q-spx(mc+1))/ + . ((spx(mc-1)-spx(mc))*(spx(mc-1)-spx(mc+1))) + + . spy(mc)*(q-spx(mc-1))*(q-spx(mc+1))/ + . ((spx(mc)-spx(mc-1))*(spx(mc)-spx(mc+1))) + + . spy(mc+1)*(q-spx(mc-1))*(q-spx(mc))/ + . ((spx(mc+1)-spx(mc-1))*(spx(mc+1)-spx(mc))) + enddo + jmax = 1 + corrmax = yinterp(1) + do j=2,21 + if (yinterp(j) .gt. corrmax) then + jmax = j + corrmax = yinterp(j) + shiftmax = xinterp(j) + endif + enddo + + +c*****translate this into a correction to the input velocity shift + deltawave = -step*shiftmax + deltavel = -3.0d5*step*shiftmax/wavecenter + veladd = veladd + deltavel + + + return + end + + + + + + + + + diff --git a/Crosscorr.f b/Crosscorr.f new file mode 100755 index 0000000..5e33d12 --- /dev/null +++ b/Crosscorr.f @@ -0,0 +1,52 @@ + + subroutine crosscorr (ishift,rxy,xcross,ycross,npx) +c****************************************************************************** +c This routine determines the correlation of array 'x' and array 'y', +c comparing array elements 'i' in 'x' with elements 'i+ishift'; +c the number of points in each array is assumed to be equal. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + real*4 xcross(100000),ycross(100000) + real*8 xsum,ysum,xysum,x2sum,y2sum,covar,varx,vary + real*8 xx,yy + + + xsum = 0. + ysum = 0. + xysum = 0. + x2sum = 0. + y2sum = 0. + if (ishift .ge. 0) then + minpt = 1 + maxpt = npx - ishift + else + minpt = iabs(ishift) + 1 + maxpt = npx + endif + + + do 10 i=minpt,maxpt + xx = xcross(i) + yy = ycross(i+ishift) + xsum = xsum + xx + ysum = ysum + yy + xysum = xysum + xx*yy + x2sum = x2sum + xx*xx +10 y2sum = y2sum + yy*yy + + + xn = real(maxpt - minpt + 1) + covar = xn*xysum - xsum*ysum + varx = dsqrt(xn*x2sum - xsum*xsum) + vary = dsqrt(xn*y2sum - ysum*ysum) + rxy = sngl(covar/(varx*vary)) + + + return + end + + + + + @@ -0,0 +1,80 @@ + + subroutine curve +c****************************************************************************** +c This routine produces a curve-of-growth for a single line +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + + +c*****set up the parameters + ewsynthopt = -1 + ncurve = 1 + dec = 10.**(rwstep) + wstart = 10.**(rwlow)*wave1(lim1) + wstop = 10.**(rwhigh)*wave1(lim1) + gf1(ncurve) = gf(lim1) + + +c*****increment the log(gf) value backward by rwstep and redo the calculations +c until the end (rwlow) is reached +31 call oneline (2) + if (w(ncurve) .gt. wstart) then + gf1(ncurve) = gf1(ncurve)/dec + do i=1,ntau + kapnu0(lim1,i) = kapnu0(lim1,i)/dec + enddo + go to 31 + endif + go to 61 + + +c*****increment the log(gf) value forward by rwstep and redo the calculations +c until the end (rwhigh) is reached +60 gf1(ncurve) = gf1(ncurve-1)*dec + do i=1,ntau + kapnu0(lim1,i) = kapnu0(lim1,i)*dec + enddo +61 call oneline (2) + if (w(ncurve) .lt. wstop) then + ncurve = ncurve + 1 + go to 60 + endif + + +c*****end the computations with a summary print + if (nf2out .ne. 0 .and. lim1 .eq. 1) + . write (nf2out,1001) moditle + do i=1,ncurve + w(i) = dlog10(w(i)/wave1(lim1)) + gf1(i) = dlog10(gf1(i)) + enddo + iatom = atom1(lim1) + if(iatom .ge. 100) iatom = 1 + abund = dlog10(xabund(iatom)) + 12. + write (nf1out,1002) wave1(lim1),atom1(lim1),e(lim1,1), + . abund,ncurve + write (nf1out,1003) (gf1(i),w(i),i=1,ncurve) + if (nf2out .eq. 0) return + write (nf2out,1002) wave1(lim1),atom1(lim1),e(lim1,1), + . abund,ncurve + write (nf2out,1003) (gf1(i),w(i),i=1,ncurve) + return + + +c*****format statements +1001 format (a80) +1002 format(/'wavelength =', f9.3,5x, 'species =', f6.1,5x, 'ep =', + . f7.3, 'abundance =', f10.3, 5x, 'n =',i2) +1003 format(' curve of growth in (loggf,logrw) pairs'/ + . (5(f7.3,',',f7.3))) +1004 format (10f7.3) + + + end + + + diff --git a/Dampdat.com b/Dampdat.com new file mode 100755 index 0000000..a0eecd0 --- /dev/null +++ b/Dampdat.com @@ -0,0 +1,17 @@ + + +c****************************************************************************** +c this common block has data relating (so far) to Barklem damping +c quantities; in the future it may be expanded +c****************************************************************************** + + real*8 wavebk(30000), idbk(30000), gammabk(30000), alphabk(30000) + real*8 gammarad(30000) + real*8 wavemin, wavemax + integer firstread, numbark, nummin, nummax + + common/dampdat/ wavebk, idbk, gammabk, alphabk, + . gammarad, + . wavemin, wavemax, + . firstread, numbark, nummin, nummax + diff --git a/Damping.f b/Damping.f new file mode 100755 index 0000000..924b574 --- /dev/null +++ b/Damping.f @@ -0,0 +1,201 @@ + + subroutine damping (linnumber) +c****************************************************************************** +c This subroutine computes damping 'gamma' factors +c and then Voigt parameters 'a' +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + + + j = linnumber + iwave = int(wave1(j)) + iatom10 = nint(10.*atom1(j)) + if (dampnum(j) .lt. 0.) dampnum(j) = 10.**dampnum(j) + + +c*****for a few lines, explicit detailed broadening terms have +c appeared in the literature, and so do these lines with a +c sepaarate subroutine + if (itru .eq. 0) then +c Ca II + if (iatom10 .eq. 201) then + if (iwave .eq. 8498 .or. + . iwave .eq. 8542 .or. + . iwave .eq. 8662 .or. + . iwave .eq. 3933) then + call trudamp (j) + damptype(j) = 'TRUEgam' + return + endif +c CH + elseif(iatom10 .eq. 1060) then + if (iwave .eq. 3693) then + call trudamp (j) + damptype(j) = 'TRUEgam' + return + endif +c Ca I + elseif (iatom10 .eq. 200) then + if (iwave.eq.6717 .or. iwave.eq.6318 + . .or. iwave.eq.6343 .or. iwave.eq.6361) then + call trudamp (j) + damptype(j) = 'TRUEgam' + return + endif +c Ca I autoionization + elseif (iatom10 .eq. 200) then + if (iwave.eq.6318 .or. + . iwave.eq.6343 .or. + . iwave.eq.6361) then + call trudamp (j) + damptype(j) = 'TRUEgam' + return + endif + endif + endif + + +c*****here are the calculations to set up the damping; for atomic lines +c there are several options: +c dampingopt = 0 and dampnum = 0 ---> +c c6 = Unsold formula +c dampingopt = 0 and dampnum < 10^(-15) ---> +c c6 = dampnum +c dampingopt = 0 and 10^(-15) < dampnum < 10^(-5) ---> +c gamma = dampnum +c dampingopt = 0 and dampnum(i) > 10^(-5) ---> +c c6 = (Unsold formula)*dampnum +c dampingopt = 1 ---> +c gammav = gamma_Barklem if possible, +c otherwise use dampingopt=0 options +c dampingopt = 2 ---> +c c6 = c6_Blackwell-group +c dampingopt = 3 and dampnum <= 10^(-10) ---> +c c6 = c6_NEXTGEN for H I, He I, H2 +c dampingopt = 3 and dampnum > 10^(-10) ---> +c c6 = (c6_NEXTGEN for H I, He I, H2)*dampnum +c for molecular lines (lacking a better idea) ---> +c c6 done as in dampingopt = 0 + + +c*****these damping calculations are done at each atmosphere level + if (linprintopt .gt. 2) write (nf1out,1001) j, wave1(j) + do i=1,ntau + ich = nint(charge(j)) + v1 = dsqrt(2.1175d8*t(i)*(1.0/amass(j)+1.008)) + + +c*****first calculate an Unsold approximation to gamma_VanderWaals + if (atom1(j) .gt. 100.) then + ebreakup = 7.0 + else + ebreakup = chi(j,ich) + endif + if (e(j,1).ge.ebreakup .or. e(j,2).ge.ebreakup) then + unsold = 1.0e-33 + else + unsold = dabs(1.61d-33*(13.598*charge(j)/(ebreakup - + . e(j,1)))**2 - 1.61d-33*(13.598*charge(j)/ + . (ebreakup-e(j,2)))**2) + endif + + +c*****dampingopt = 0 or +c*****dampingopt = 1 and no Barklem data + if (dampingopt .eq. 0 .or. + . (dampingopt.eq.1 .and. gambark(j).lt.0)) then + if (dampnum(j) .eq. 0.0) then + damptype(j) = 'UNSLDc6' + gammav = 17.0*unsold**0.4*v1**0.6*numdens(1,1,i) + elseif (dampnum(j) .lt. 1.0d-15) then + damptype(j) = ' MYc6' + gammav = 17.0*dampnum(j)**0.4*v1**0.6*numdens(1,1,i) + elseif (dampnum(j) .lt. 1.0d-04) then + damptype(j) = 'MYgamma' + gammav = dampnum(j)*(t(i)/10000.)**0.3*numdens(1,1,i) + else + damptype(j) = 'MODUNc6' + gammav = + . 17.0*(unsold*dampnum(j))**0.4*v1**0.6*numdens(1,1,i) + endif + + +c*****dampingopt = 1 with extant Barklem data + elseif (dampingopt.eq.1 .and. gambark(j).gt.0.) then + damptype(j) = 'BKgamma' + gammav = + . gambark(j)*(t(i)/10000.)**alpbark(j)*numdens(1,1,i) + + +c*****dampingopt = 2 + elseif (dampingopt .eq. 2) then + damptype(j) = 'BLKWLc6' + gammav = 17.0*((1.0 + 0.67*e(j,1))*unsold)**0.4* + . v1**0.6*numdens(1,1,i) + + +c*****dampingopt = 3 + elseif (dampingopt .eq. 3) then + damptype(j) = 'NXTGNc6' + if (dampnum(j) .le. 1.0d-10) dampnum(j) = 1.0 + c6h = dabs(1.01d-32*(charge(j)**2)* + . (13.598/(ebreakup - e(j,1)))**2 - 1.61d-33* + . (13.598/(ebreakup-e(j,2)))**2) + c6he = dabs((0.204956/0.666793)*1.01d-32* + . (charge(j)**2)*(13.598/(ebreakup - + . e(j,1)))**2 - 1.61d-33*(13.598/(ebreakup- + . e(j,2)))**2) + c6ht = dabs((0.806/0.666793)*1.01d-32* + . (charge(j)**2)*(13.598/(ebreakup - + . e(j,1)))**2 - 1.61d-33*(13.598/(ebreakup- + . e(j,2)))**2) + gammav = 17.0*v1**0.6*(c6h**0.4*numdens(1,1,i) + + . c6he**0.4*numdens(2,1,i) + + . c6ht**0.4*numdens(8,1,i))*dampnum(j)**0.4 + endif + + +c*****compute radiative broadening either by an approximate formula or +c*****the value in Barklem.dat) + if (gamrad(j).ne.0.0 .and. dampingopt .eq. 1) then + gammar = gamrad(j) + else + gammar = 2.223d15/wave1(j)**2 + endif + + +c*****now Stark broadening (approximate formulae) + excdiff = chi(j,nint(charge(j))) - e(j,2) + if (excdiff .gt. 0.0 .and. atom1(j).lt.100.) then + effn2 = 13.6*charge(j)**2/excdiff + else + effn2 = 25. + endif + gammas = 1.0e-8*ne(i)*effn2**2.5 + + +c*****now finish by summing the gammas and computing the Voigt *a* values + gammatot = gammar + gammas + gammav + a(j,i) = gammatot*wave1(j)*1.0d-8/(12.56636*dopp(j,i)) + if (linprintopt .gt. 2) write (nf1out,1002) i, gammar, + . gammas, gammav, gammatot, a(j,i) + enddo + return + + +c*****format statements +1001 format(//' LINE BROADENING PARAMETERS FOR LINE', i4, + . ' AT WAVELENGTH',f8.2/ + . ' i',4x,'natural',6x,'Stark',4x,'VdWaals', + . 6x,'total',5x,'a(j,i)') +1002 format (i3,1p5e11.3) + + + end + + + + diff --git a/Defcolor.f b/Defcolor.f new file mode 100755 index 0000000..16e1c85 --- /dev/null +++ b/Defcolor.f @@ -0,0 +1,36 @@ + + subroutine defcolor (icolor) +c****************************************************************************** +c This routine decides on whether to call for a black & white hardcopy +c plot or a colorful screen plot +c****************************************************************************** + + include 'Pstuff.com' + character*7 colors(8) + + +c*****assign colors to character arrays + colors(1) = 'white ' + colors(2) = 'red ' + colors(3) = 'cyan ' + colors(4) = 'yellow ' + colors(5) = 'green ' + colors(6) = 'magenta' + colors(7) = 'blue ' + colors(8) = 'black ' + + + if (choice.eq.'h' .or. choice.eq.'f' .or. + . choice.eq.'g') then + call sm_ctype (colors(8)) + else + call sm_ctype (colors(icolor)) + endif + + + return + end + + + + diff --git a/Discov.f b/Discov.f new file mode 100755 index 0000000..16e426d --- /dev/null +++ b/Discov.f @@ -0,0 +1,23 @@ + + subroutine discov(amol,i1,i2) +c****************************************************************************** +c This routine returns i2 = the number of times atom i1 appears in +c molecule amol +c****************************************************************************** + + implicit real*8 (a-h,o-z) + integer itest(5) + data itest /100000000, 1000000, 10000, 100, 1/ + i2 = 0 + im = amol + do i=1,5 + i3 = im/itest(i) + if(i3 .eq. i1) i2 = i2 + 1 + im = im - i3*itest(i) + enddo + return + + + end + + diff --git a/Doflux.f b/Doflux.f new file mode 100755 index 0000000..8783723 --- /dev/null +++ b/Doflux.f @@ -0,0 +1,91 @@ + + subroutine doflux +c****************************************************************************** +c This routine produces flux curves +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Dummy.com' + include 'Pstuff.com' + + +c*****examine the parameter file + call params + +c*****open the files for standard output and summary curves-of-growth + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = 6 + array = 'SUMMARY FLUX OUTPUT' + nchars = 19 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + nf5out = 26 + lscreen = lscreen + 2 + array = 'POSTSCRIPT PLOT OUTPUT' + nchars = 22 + call infile ('output ',nf5out,'formatted ',0,nchars, + . f5out,lscreen) + + +c*****open and read the model atmosphere + nfmodel = 30 + lscreen = lscreen + 2 + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****compute the flux curve + wave = start +1 call opacit (2,wave) + if (modprintopt .ge. 2) + . write(nf1out,1002) wave,(kaplam(i),i=1,ntau) + call cdcalc (1) + first = 0.4343*cd(1) + flux = rinteg(xref,cd,dummy1,ntau,first) + if (flux .le. 0.1) flux = 0. + if (iunits .eq. 1) then + write (nf1out,1003) 1.d-4*wave,flux + else + write (nf1out,1004) wave,flux + endif + waveinv = 1.0d4/wave + if (flux .gt. 0.) then + fluxlog = dlog10(flux) + else + fluxlog = -1.0 + endif + write (nf2out,1001) wave, flux, waveinv, fluxlog + wave = wave + step + if (wave .le. sstop) go to 1 + call pltflux + + +c****end the computations + call finish (0) + return + + +c*****format statements +1001 format (1p2d12.4,0p2f10.4) +1002 format (' kaplam from 1 to ntau at wavelength',f11.3/ + 1 (6(1pd12.4))) +1003 format ('AT WAVELENGTH/FREQUENCY =',f11.7, + . ' CONTINUUM FLUX/INTENSITY =', 1pd12.5) +1004 format ('AT WAVELENGTH/FREQUENCY =',f11.3, + . ' CONTINUUM FLUX/INTENSITY =', 1pd12.5) + + + end + + diff --git a/Drawcurs.f b/Drawcurs.f new file mode 100755 index 0000000..3e2871f --- /dev/null +++ b/Drawcurs.f @@ -0,0 +1,51 @@ + + subroutine drawcurs +c****************************************************************************** +c This subroutine draws an arrow and writes the user x- and y-positions +c of the cursor upon a click +c****************************************************************************** + + include 'Pstuff.com' + integer ichr + + + call sm_graphics + if (whichwin .eq. '1of1') then + call sm_window (1,1,1,1,1,1) + elseif (whichwin .eq. '2of2') then + call sm_defvar ('y_gutter','0.0') + call sm_window (1,2,1,1,1,1) + endif + call sm_curs (xplotpos,yplotpos,ichr) + + + call sm_relocate (xplotpos,yplotpos-0.10*(yhi-ylo)) + call sm_draw (xplotpos,yplotpos) + call sm_draw (xplotpos-0.01*(xhi-xlo),yplotpos-0.03*(yhi-ylo)) + call sm_relocate (xplotpos,yplotpos) + call sm_draw (xplotpos+0.01*(xhi-xlo),yplotpos-0.03*(yhi-ylo)) + call writenumber (xplotpos) + call sm_expand (0.6) + call sm_relocate (xplotpos,yplotpos-0.11*(yhi-ylo)) + call sm_putlabel (5,array) + call writenumber (yplotpos) + if (whichwin(4:4) .eq. '1') then + call sm_relocate (xplotpos,yplotpos-0.15*(yhi-ylo)) + elseif (whichwin(4:4) .eq. '2') then + call sm_relocate (xplotpos,yplotpos-0.18*(yhi-ylo)) + elseif (whichwin(4:4) .eq. '3') then + call sm_relocate (xplotpos,yplotpos-0.21*(yhi-ylo)) + endif + call sm_putlabel (5,array) + + + call sm_gflush + call sm_alpha + + + + return + end + + + diff --git a/Dummy.com b/Dummy.com new file mode 100755 index 0000000..4a0726e --- /dev/null +++ b/Dummy.com @@ -0,0 +1,11 @@ + +c****************************************************************************** +c this simply is a "scratch" common block that holds arrays +c that are temporary and will be "recycled" for different +c internal calculation purposes. +c****************************************************************************** + + real*8 dummy1(100), dummy2(100), dummy3(5000), dummy4(5000) + + common/dummy/dummy1, dummy2, dummy3, dummy4 + @@ -0,0 +1,288 @@ + + subroutine eqlib +c****************************************************************************** +c This routine solves the equations of molecular dissociative +c equilibrium. the equations can include neutral and ionized molecules +c and atoms +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Mol.com' + include 'Quants.com' + include 'Dummy.com' + real*8 xfic(30), xcorr(30), deltax(30), c(30,30), ans(30,30) + real*8 uu(2) + real*8 lth + integer ident(30,110) + + +c*****clear the arrays + iorder(1) = 0 + neq = iorder(1) + tdel = (t(ntau)-t(1))/4.0 + 1.0 + do k=1,30 + iorder(k) = 0 + xcorr(k) = 0. + do kk=1,110 + ident(k,kk) = 0 + enddo + enddo + + +c*****the number of species to be considered has been defined in "Inmodel"; +c*****either read in the dissociation data for a molecular species + do jmol=1,nmol + if (amol(jmol) .ge. 100.) then + do k=1,110 + if (datmol(1,k) .eq. amol(jmol)) go to 11 + enddo + write (nf1out,1001) amol(jmol) + stop +11 do kk=1,6 + const(kk,jmol) = datmol(kk+1,k) + enddo + + +c*****or read the ionization data for an atomic species + else + iatom1 = amol(jmol) + 0.0001 + atom = iatom1 + const(1,jmol) = xchi1(iatom1) + do kk=1,5 + ti = t(1) + (kk-1)*tdel + it = ti + do jj=1,2 + att = atom+0.1*(jj-1) + if (partflag(iatom1,jj) .gt. 0) then + uu(jj) = partnew(att,jj,it) + else + uu(jj) = ucalc(att,it) + endif + enddo + const(kk+1,jmol) = uu(2)/uu(1) + enddo + endif + enddo + if (molopt .ge. 2) + . write (nf1out,1002) (amol(i),(const(j,i),j=1,6),i=1,nmol) + + +c*****set up the molecular equilibrium array. each element of array +c*****'ident' contains the identifier (subscript of an element of +c*****array 'amol') of an ion or a molecule. the neutral atom is always +c*****understood, but is not explicitly contained in 'ident'. + nmax = 1 + do jmol=1,nmol + atom = amol(jmol) +2 call sunder(atom,iatom1,iatom2) + do k=1,30 + if (iatom1 .eq. iorder(k)) go to 4 + enddo + neq = neq + 1 + iorder(neq) = iatom1 + ident(neq,1) = jmol + go to 6 +4 do kk=1,nmax + if (ident(k,kk).eq.0 .or. ident(k,kk).eq. jmol) go to 7 + enddo + nmax = nmax + 1 + kk = nmax +7 ident(k,kk) = jmol +6 if (iatom2 .ne. 0) then + atom = iatom2 + go to 2 + endif + enddo + if (molopt .ge. 2) then + do i=1,neq + dummy1(i) = iorder(i) + enddo + write (nf1out,1003) (dummy1(i),i=1,neq),(amol(i),i=1,nmol) + endif + + +c*****now begin the loop that goes through all the atmosphere tau layers + do 21 kev=1,ntau + + +c*****calculate *xfic* and make a first guess at *xatom* + i = ntau + 1 - kev + lev = i + tk = 1.38065d-16*t(i) + do k=1,neq + korder = iorder(k) + xfic(k) = xabund(korder)*nhtot(i) + enddo + if (i .lt. ntau) then + do k=1,neq + xatom(k) = xatom(k)*nhtot(i)/nhtot(i+1) + enddo + else + do k=1,neq + xatom(k) = xfic(k) + enddo + endif + + +c*****compute the number of molecules: +c*****Here is some information about the equilibrium constants. +c*****The equilibrium constants, Kp, are defined as follows: +c +c +c P(A)*P(B) N(A)*N(B) +c Kp(AB) = --------- = kT--------- = +c P(AB) N(AB) +c +c 2*pi*kT 3/2 M(A)*M(B) 3/2 Q(A)*Q(B) +c = kT*(-------) * (---------) * --------- * exp(-D(AB)/kT) +c h^2 M(AB) Q(AB) +c +c +c*****MOOG uses: n(AB)/n(A)n(B) = kt/Kp +c +c Kp - dissociation constant, Q - partition functions, M - masses +c P - partial pressures, N - number densities, T - temperature, +c D - dissociation energy, h - plank constant. Remember to use +c masses in grams (1 amu = 1.660540E-24 g) and energy in ergs +c (1 eV = 1.60219E-12 ergs). Also, k = 1.38065E-16 erg/K, +c h = 6.626076E-27 erg s, and pi = 3.1415926536. +27 do jmol=1,nmol + atom = amol(jmol) + if (atom .ge. 100.) then + if (t(i) .gt. 12000.) then + xmol(jmol,i) = 1.0d-20 + else + xmol(jmol,i) = 1. + count = 0. +37 call sunder(atom,iatom1,iatom2) + count = count + 1. + do k=1,neq + if (iorder(k) .eq. iatom1) + . xmol(jmol,i) = xmol(jmol,i)*xatom(k) + enddo + if (iatom2 .ne. 0) then + atom = iatom2 + go to 37 + endif + hion = 10.0*(amol(jmol) - dint(amol(jmol))) + th = 5040./t(i) + lth = log10(th) + xmol(jmol,i) = xmol(jmol,i)*(((1.38065d-16 * t(i))** + . (count-1.0))/(10.0**(const(2,jmol)+(const(3,jmol)* + . lth)+(const(4,jmol)*(lth**2))+(const(5,jmol)* + . (lth**3))+(const(6,jmol)*(lth**4))- + . (const(1,jmol)*th))))/(ne(i)**hion) + endif + + +c*****compute the number of ions: + else + delt = (t(i)-t(1))/tdel + m = min0(idint(delt)+2,5) + delt = delt - idint(delt) + u1 = const(m,jmol) + + . (const(m+1,jmol)-const(m,jmol))*delt + iatom1 = atom + do k=1,neq + if (iorder(k) .eq. iatom1) xmol(jmol,i) = + . 4.825d15*u1*t(i)**1.5/ne(i)*dexp(-1.1605d4* + . const(1,jmol)/t(i))*xatom(k) + enddo + endif + enddo + + +c*****compute matrix *c*, which is the derivative of each equation with +c*****respect to each atom. + do k=1,neq + deltax(k) = -xfic(k) + xatom(k) + do kk=1,neq + c(k,kk) = 0. + enddo + c(k,k) = 1. + korder = iorder(k) + do kk=1,neq + kderiv = iorder(kk) + do 28 j=1,nmax + jmol = ident(k,j) + if (jmol .eq. 0) go to 28 + call discov(amol(jmol),kderiv,num2) + if (num2 .eq. 0) go to 28 + call discov(amol(jmol),korder,num1) + c(k,kk) = c(k,kk) + xmol(jmol,i)*num1*num2/xatom(kk) + if (k .eq. kk) deltax(k) = deltax(k) + num1*xmol(jmol,i) +28 continue + enddo + enddo + + +c*****calculate array 'xcorr', the change in 'xatom'. array 'xcorr' is +c*****'deltax' multiplied by the inverse of 'c' + call invert (neq,c,ans,30) + do k=1,neq + x1 = xcorr(k) + xcorr(k) = 0. + do kk=1,neq + xcorr(k) = xcorr(k) + ans(k,kk)*deltax(kk) + enddo + enddo + + +c*****decide if another iteration is needed + iflag = 0 + do k=1,neq +c*****here oscillations are damped out + if (x1*xcorr(k) .lt. -0.5*x1**2) xcorr(k) = 0.5*xcorr(k) + x1 = xatom(k) + if (dabs(xcorr(k)/xatom(k)) .gt. 0.005) iflag = 1 + xatom(k) = xatom(k) - xcorr(k) +c*****fix element number densities which are ridiculous + if (xatom(k).le.0.0 .or. xatom(k).ge.1.001*xfic(k)) then + iflag = 1 + xatom(k) = 1.0d-2*dabs(xatom(k)+xcorr(k)) + endif + enddo + if (iflag .ne. 0) go to 27 + + +c*****print out atomic and molecular partial pressures. *xamol* is the +c*****number density for each neutral atom + do k=1,neq + xamol(k,i) = xatom(k) + patom(k) = dlog10(xatom(k)*tk) + enddo + do jmol=1,nmol + pmol(jmol) = dlog10(xmol(jmol,i)*tk) + enddo + if (molopt .ge. 2) then + pglog = dlog10(pgas(lev)) + write (nf1out,1004) lev,int(t(lev)+0.001),pglog, + . (patom(i),i=1,neq), (pmol(i),i=1,nmol) + endif + + +c*****here the big loop in tau ends +21 continue + + +c*****finally, transfer some of this number density output to other arrays + call setmols + return + + +c*****format statements +1001 format ('I do not know this molecule: ',f10.0) +1002 format (/'INPUT EQUILIBRIUM DATA:'/1x, 'species', 2x, + . 'D0/Chi ', 3x, 'const1', 6x, 'const2', 6x, + . 'const3', 6x, 'const4', 6x, 'const5'/ + . (0pf8.1, f8.3, 1p5d12.4)) +1003 format (/'MOLECULAR EQUILIBRIUM SOLUTIONS: (log partial', + . ' pressures listed under names)'/ + . 2x,'i',5x,'T',2x,'Pgas',8f8.1/(15x,8f8.1)) +1004 format (i3,i6,f6.2,8f8.2/(15x,8f8.2)) + + end + + + diff --git a/Equivs.com b/Equivs.com new file mode 100755 index 0000000..688f36c --- /dev/null +++ b/Equivs.com @@ -0,0 +1,24 @@ + +c****************************************************************************** +c this is not really a common block, but it is a way to make +c (in a consistent manner for several routines) definitions +c of some temporary variables that are equivalenced (assigned, +c or in other words, use the same memory space as) other variables. +c This is done so that plotting of large numbers of points (<=50000) +c for synthetic spectra may be accomplished without allocating +c large amounts of additional memory for the code. +c****************************************************************************** + + real*4 chunk(100000,5) + equivalence (chunk(1,1),a(1,1)), + . (chunk(1,2),a(1,21)), + . (chunk(1,3),a(1,41)), + . (chunk(1,4),a(1,61)), + . (chunk(1,5),a(1,81)) + + real*4 xsyn(100000), dev(100000) + equivalence (xsyn,kapnu0(1,1)), (dev,kapnu0(1,21)) + + real*4 y(100000), z(100000) + equivalence (y,kapnu0(1,41)), (z,kapnu0(1,61)) + diff --git a/Ewfind.f b/Ewfind.f new file mode 100755 index 0000000..9bedf3d --- /dev/null +++ b/Ewfind.f @@ -0,0 +1,214 @@ + + subroutine ewfind +c****************************************************************************** +c This routine predicts equivalent widths for individual atomic lines +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Pstuff.com' + include 'Dummy.com' + real*8 taunu0(100) + character*4 ion(3) + data ion/' I ', ' II ', ' III'/ + +c*****read the parameter file + call params + +c*****open the files for standard output and summary curves-of-growth + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = lscreen + 2 + array = 'SUMMARY PREDICTED EW OUTPUT' + nchars = 27 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + + +c*****open and read the model atmosphere + nfmodel = 30 + lscreen = lscreen + 2 + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****open and read the line list file; get ready for the line calculations + nflines = 31 + lscreen = lscreen + 2 + array = 'THE LINE LIST' + nchars = 13 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + call inlines (1) + call eqlib + call nearly (1) + + +c*****set some parameters and write header stuff to output + ewsynthopt = +1 + mode = 1 + call linlimit + lim1obs = lim1line + lim2obs = lim2line + istat = ivcleof (4,1) + write (nf2out,1002) linitle,moditle + + +c*****run single line computations once to predict the EW for each line + do lim1=lim1line,lim2line + array(1:40) = 'wavelength EP logGF ident' + array(41:60) = ' Abund EWcalc' + lscreen = lscreen + 2 +c call prinfo (lscreen) + write (nf2out,1001) + ncurve = lim1 + lim2 = lim1 + gf1(ncurve) = gf(lim1) + call oneline (1) + widout(lim1) = w(ncurve) + iatom = atom1(lim1) + xab = dlog10(xabund(iatom)) + 12. + ich = idint(charge(lim1) + 0.1) + if (iatom .lt. 100) then + write (array,1003) wave1(lim1), e(lim1,1), + . dlog10(gf(lim1)), names(iatom), + . ion(ich), xab, 1000.*widout(lim1) + lscreen = lscreen + 2 +c call prinfo (lscreen) + write (nf2out,1003) wave1(lim1), e(lim1,1), + . dlog10(gf(lim1)), names(iatom), + . ion(ich) ,xab, 1000.*widout(lim1) + else + write (array,1004) wave1(lim1), e(lim1,1), + . dlog10(gf(lim1)), atom1(lim1), + . xab, 1000.*widout(lim1) + lscreen = lscreen + 2 +c call prinfo (lscreen) + write (nf2out,1004) wave1(lim1), e(lim1,1), + . dlog10(gf(lim1)), atom1(lim1), + . xab, 1000.*widout(lim1) + endif + + +c*****(re)compute the line optical depth at line center and the C_d curve + do i=1,ntau + kapnu(i) = kapnu0(lim1,i) + dummy1(i) = tauref(i)*kapnu(i)/(0.4343*kapref(i)) + enddo + first = tauref(1)*kapnu(1)/kapref(1) + dummy2(1) = rinteg(xref,dummy1,taunu0,ntau,0.) + taunu0(1) = first + do i=1,ntau + taunu(i) = taunu0(i) + enddo + call cdcalc (2) + do i=2,ntau + taunu0(i) = taunu0(i-1) + taunu0(i) + enddo + write (nf2out,1010) + write (nf2out,1011) (i, rhox(i), xref(i), int(t(i)), + . pgas(i), rho(i), xdepth(i), taulam(i), + . taunu0(i), cd(i), i=1,ntau) + + +c*****compute layer where continuum optical depth > 1 + do i=1,ntau + if (taulam(i) .ge. 1.) then + xdepthlam1 = xdepth(i-1) + (1.-taulam(i-1))* + . (xdepth(i)-xdepth(i-1))/(taulam(i)-taulam(i-1)) + write (nf2out,1013) int(xdepthlam1), i + go to 10 + endif + enddo + + +c compute layer where line center optical depth > 1 +10 if (taunu0(ntau) .lt. 1.) then + write (nf2out,1016) + go to 20 + endif + do i=1,ntau + if (taunu0(i) .ge. 1.) then + xdepthnu01 = xdepth(i-1) + (1.-taunu0(i-1))* + . (xdepth(i)-xdepth(i-1))/(taunu0(i)-taunu0(i-1)) + write (nf2out,1014) int(xdepthnu01), i + go to 20 + endif + enddo + + +c compute layer where line center plus continuum optical depth > 1 +20 do i=1,ntau + if (taunu0(i)+taulam(i) .ge. 1.) then + tautot1 = taulam(i-1) + taunu0(i-1) + tautot2 = taulam(i) + taunu0(i) + xdepthtot1 = xdepth(i-1) + (1.-tautot1)* + . (xdepth(i)-xdepth(i-1))/(tautot2-tautot1) + write (nf2out,1015) int(xdepthtot1), i + go to 30 + endif + enddo + + +*****compute mean line-center formation level (weight: contribution function) +30 do i=1,ntau + dummy1(i) = xref(i)*dabs(cd(i)) + enddo + xrefcdinteg = rinteg(xref,dummy1,dummy2,ntau,0.) + do i=1,ntau + dummy1(i) = dabs(cd(i)) + enddo + cdinteg = rinteg(xref,dummy1,dummy2,ntau,0.) + xrefmean = xrefcdinteg/cdinteg + do i=1,ntau + if (xrefmean .le. xref(i)) then + xdepthxrefmean = xdepth(i-1) + (xrefmean-xref(i-1))* + . (xdepth(i)-xdepth(i-1))/(xref(i)-xref(i-1)) + write (nf2out,1017) int(xdepthxrefmean), i, tauref(i), + . taulam(i) + go to 40 + endif + enddo +40 continue + enddo + + +c*****end the abundance computations + call finish (0) + return + + +c*****format statements +1001 format (/'wavelength EP logGF ident', + . ' Abund EWcalc') +1002 format (a80) +1003 format (f10.2,f10.2,f10.3,' ',a2,a3,f10.2,f10.1) +1004 format (f10.2,f10.2,f10.3,a10,f10.2,f10.1) +1010 format (' i', 2x, 'rhox', 5x, 'xref', 5x, 'T', 5x, 'Pgas', + . 6x, 'rho', 8x, 'X', 3x, 'taulam', 3x, 'taunu0', + . 8x, 'Cd') +1011 format (i3, 1pe9.2, 0pf6.2, i6, 1p5e9.2, e10.2) +1013 format (i7, 'km (layer ~', i3, ') = physical depth', + . ' for tau(cont) ~ 1') +1014 format (i7, 'km (layer ~', i3, ') = physical depth', + . ' for tau(line center) ~ 1') +1015 format (i7, 'km (layer ~', i3, ') = physical depth', + . ' for tau(cont)+tau(line center) ~ 1') +1016 format (7x,' NOTE: tau(line center) < 1 at deepest', + . ' atmosphere layer') +1017 format (i7, 'km (layer ~', i3, ') = line center ', + . 'formation mean depth; C_d weight'/ + . 25x, 'where tauref, taulam =', 2f8.3) + + end + diff --git a/Ewweighted.f b/Ewweighted.f new file mode 100755 index 0000000..bbbb397 --- /dev/null +++ b/Ewweighted.f @@ -0,0 +1,86 @@ + + subroutine ewweighted +c****************************************************************************** +c This routine computes a weighted mean EW for one line from a set +c of models +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Multimod.com' + + +c*****start the computations for a line + if (dabs(rwlgerror) .lt. 0.01) write (nf7out,1001) + ewweighttot = 0. + weighttot = 0 + modcount = 0 + iatom = int(atom1(lim1)+0.0001) + xngf = dlog10(xabund(iatom)*gf(lim1)) + deltangf + + +c*****for each model, interpolate in the curve-of-growth to get an EW_calc +c for the assumed abundance + do mmod=1,modtot + ncurvetot = nmodcurve(mmod,lim1) + do icurve=3,ncurvetot-2 + if (gfmodtab(mmod,lim1,icurve) .gt. xngf) then + ic = icurve - 1 + pp = (xngf-gfmodtab(mmod,lim1,ic))/0.15 + rw = rwmodtab(mmod,lim1,ic-1)*(-pp)*(pp-1.)*(pp-2.)/6. + + . rwmodtab(mmod,lim1,ic)*(pp*pp-1.)*(pp-2.)/2. + + . rwmodtab(mmod,lim1,ic+1)*(-pp)*(pp+1.)*(pp-2.)/2. + + . rwmodtab(mmod,lim1,ic+2)*pp*(pp*pp-1.)/6. + ew = 10**rw*wave1(lim1) + go to 10 + endif + enddo + +c*****add this EW to the total, weighting it by flux*radius^2*relcount +10 ewweight = ew*weightmod(mmod,lim1) + weighttot = weighttot + weightmod(mmod,lim1) + ewweighttot = ewweighttot + ewweight + if (dabs(rwlgerror) .lt. 0.01) + . write (nf7out,1005) fmodinput(mmod), + . fmodoutput(mmod), radius(mmod), relcount(mmod), + . fluxmod(mmod,lim1), weightmod(mmod,lim1), + . 1000.*ew, 1000.*ewweight + enddo + + +c*****write out the mean EW + ewmod(lim1) = ewweighttot/weighttot + abundout(lim1) =dlog10(xabund(iatom))+deltangf+12. + if (dabs(rwlgerror) .lt. 0.01) then + write(nf7out,1006) atom1(lim1), wave1(lim1), e(lim1,1), + . dlog10(gf(lim1)), 1000.*ewmod(lim1), + . abundout(lim1) + endif +c write (nf7out,1006) 1000.*ewmod(lim1), abundout(lim1) + return + + +c*****format statements +1001 format ('MODFILE', 5x, 'COGOUT', 9x, 'RADIUS', 3x, '*COUNT', + . 5x, 'FLUX', 3x, 'WEIGHT', 5x, 'EW', ' EWWEIGHT') +1005 format (2a12, 1pe9.2, e9.2, e9.2, e9.2, 0pf7.1, 1pe9.2) +c1006 format ('EWmean, Abundance =', f8.1, f8.2) +1006 format ('Final: ', f5.1, 3x, f8.3, 3x, f6.3, 3x,f7.3,1x,f8.1, + . 1x,f8.2) + + + end + + + + + + + + + + + + + diff --git a/Factor.com b/Factor.com new file mode 100755 index 0000000..28a72eb --- /dev/null +++ b/Factor.com @@ -0,0 +1,27 @@ + +c****************************************************************************** +c this common block is used for multiple syntheses, and contains +c abundance information that MOOG uses to figure out what will be +c altered for the different syntheses. +c****************************************************************************** + + real*8 pecabund(95,5), newpecabund(95,5), abfactor(5) + integer pec(95), newpec(95), + . numpecatom, newnumpecatom, + . numatomsyn, newnumatomsyn, + . isynth, ninetynineflag + real*8 isotope(20), newisotope(20), + . isoabund(20,5), newisoabund(20,5) + integer numiso, newnumiso, + . numisosyn, newnumisosyn, isorun + + common/newfact/pecabund, newpecabund, abfactor, + . pec, newpec, + . numpecatom, newnumpecatom, + . numatomsyn, newnumatomsyn, + . isynth, ninetynineflag + common/iso/ isotope, newisotope, + . isoabund, newisoabund, + . numiso, newnumiso, + . numisosyn, newnumisosyn, isorun + diff --git a/Fakeline.f b/Fakeline.f new file mode 100755 index 0000000..076bf18 --- /dev/null +++ b/Fakeline.f @@ -0,0 +1,91 @@ + + subroutine fakeline +c****************************************************************************** +c This routine creates a representative atomic line with parameters +c that are arbitrarily set in this routine. Then this line is used to +c generate a curve-of-growth for use with the 'abfind' routine. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Quants.com' + include 'Dampdat.com' + + +c*****specify the input parameters of a representative "fake" line; +c*****here we use a real Fe I line because it has Barklem damping data + wave1(1) = 5006.126 + atom1(1) = 26.0 + e(1,1) = 2.833 + e(1,2) = 5.308 + gf(1) = 1.0e-3 + iatom = atom1(1) + charge(1) = 1.0 + amass(1) = xam(iatom) + chi(1,1) = xchi1(iatom) + chi(1,2) = xchi2(iatom) + chi(1,3) = xchi3(iatom) + gammabk(1) = -7.280 + alphabk(1) = 0.238 + gambark(1) = 10.**gammabk(1) + alpbark(1) = (1.-alphabk(1))/2. + if (dampingopt .eq. 0) then + damptype(1) = 'UNSLDc6' + elseif (dampingopt .eq. 1) then + damptype(1) = 'BKgamma' + elseif (dampingopt .eq. 2) then + damptype(1) = 'BLKWLc6' + else + damptype(1) = 'NEXTGEN' + endif + + +c*****do the partition function + call partfn (atom1(1),int(atom1(1)+0.001)) + + +c*****now calculate the dependent quantities, such as doppler parameters, +c damping constant, line opacity at line center + lim1line = 1 + lim2line = 1 + nlines = 1 + idump = nf2out + nf2out = 0 + call nearly (3) + + +c*****setting some counting parameters and do a curve-of-growth + lim1 = 1 + lim2 = 1 + rwlow = -6.7 + rwhigh = -3.7 + rwstep = 0.15 + call curve + nf2out = idump + + +c*****make an interpolated curve-of-growth at very small log gf steps + do i=2,ncurve-2 + k = 30*(i-2) + l = -1 + do m=k+1,k+30 + l = l + 1 + pp = 0.005/0.15*(l-1) + gftab(m) = gf1(2) + 0.005*(m-1) + rwtab(m) = w(i-1)*(-pp)*(pp-1.)*(pp-2.)/6. + + . w(i)*(pp*pp-1.)*(pp-2.)/2. + + . w(i+1)*(-pp)*(pp+1.)*(pp-2.)/2. + + . w(i+2)*pp*(pp*pp-1.)/6. + enddo + enddo + ntabtot = m - 1 + + +c*****exit back to the abfind driver + return + end + + + + diff --git a/Findtic.f b/Findtic.f new file mode 100755 index 0000000..b7d8b99 --- /dev/null +++ b/Findtic.f @@ -0,0 +1,36 @@ + + subroutine findtic (end1,end2,bigtic,smltic) +c****************************************************************************** +c this routine makes tic marks at nice round intervals. +c****************************************************************************** + + implicit real*8(a-h,o-z) + real*4 end1, end2, bigtic, smltic, span, spanlog + + + span = end2 - end1 + if (span .lt. 0.) span = - span + spanlog = alog10(span) + size = ifix(spanlog) + if (spanlog .lt. 0.) size = size - 1 + chop = spanlog - size + if (chop .lt. 0.31) then + bigtic = 10.**(size)/2 + smltic = bigtic/5 + elseif (chop .lt. 0.71) then + bigtic = 10.**(size) + smltic = bigtic/5 + else + bigtic = 10.**(size)*2 + smltic = bigtic/4 + endif + return + + + end + + + + + + diff --git a/Finish.f b/Finish.f new file mode 100755 index 0000000..d2ab425 --- /dev/null +++ b/Finish.f @@ -0,0 +1,46 @@ + + subroutine finish (number) +c****************************************************************************** +c This routine simply wraps up MOOG +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Pstuff.com' + + +c close the files + if (nfmodel .ne. 0) close (unit=nfmodel) + if (nflines .ne. 0) close (unit=nflines) + if (nfslines .ne. 0) close (unit=nfslines) + if (nftable .ne. 0) close (unit=nftable) + if (nfobs .ne. 0) close (unit=nfobs) + if (nf1out .ne. 0) close (unit=nf1out) + if (nf2out .ne. 0) close (unit=nf2out) + if (nf3out .ne. 0) close (unit=nf3out) + if (nf4out .ne. 0) close (unit=nf4out) + if (nf5out .ne. 0) close (unit=nf5out) + if (control .ne. 'gridsyn' .and. control .ne. 'gridplo') then + if (nf6out .ne. 0) close (unit=nf6out) + if (nf7out .ne. 0) close (unit=nf7out) + if (nf8out .ne. 0) close (unit=nf8out) + if (nf9out .ne. 0) close (unit=nf9out) + if (nf10out .ne. 0) close (unit=nf10out) + endif + +c write the closing message + if (number .eq. 0) then + istat = ivcleof (4,1) + write (array,1001) + istat = ivwrite (5,1,array,79) + endif + return + + +c*****format statements +1001 format (22('<'),10x,'MOOG HAS ENDED!',10x,22('>')) + + + end + + diff --git a/Fluxplot.f b/Fluxplot.f new file mode 100755 index 0000000..7393a3a --- /dev/null +++ b/Fluxplot.f @@ -0,0 +1,98 @@ + + subroutine fluxplot +c****************************************************************************** +c This subroutine creates plots of flux curves +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Dummy.com' + include 'Pstuff.com' + real*8 wavep(2000), fluxp(2000) + real*4 waveplot(2000), flxplt(2000) + real*4 style(1) + + +c*****dump the data into working arrays + rewind nf2out + i = 1 +1 read (nf2out,*,end=10) wavep(i), fluxp(i), waveplot(i), flxplt(i) + i = i + 1 + go to 1 + + +c*****define the plot boundaries +10 ntot = i - 1 + xlo = int(waveplot(1)) + xhi = int(waveplot(ntot)) + ylo = 1.e+30 + yhi = -1.e+30 + do i=1,ntot + ylo = amin1(ylo,flxplt(i)) + yhi = amax1(yhi,flxplt(i)) + enddo + ylo = real(int(ylo+0.5001)) - 0.5 + yhi = real(int(yhi+0.5001)) + 0.5 + + +c*****start the plot via some setup calls + call sm_location (3500,31000,5000,31000) + call sm_limits (xlo,xhi,ylo,yhi) + call findtic (xlo,xhi,bigxtic,smlxtic) + call findtic (ylo,yhi,bigytic,smlytic) + call sm_ticksize (smlxtic,bigxtic,smlytic,bigytic) + + +c*****draw and label the box for the curve-of-growth + call sm_expand (0.6) + call sm_lweight (1.4) + call defcolor (1) + call sm_box (0,0,0,0) + call sm_expand (1.0) + call sm_box (1,2,4,4) + array = '1/lambda' + call sm_relocate (0.5*(xlo+xhi),ylo-0.20*(yhi-ylo)) + call sm_putlabel (5,array) + array = 'log (flux)' + call sm_relocate (xlo-0.10*(xhi-xlo),0.5*(yhi+ylo)) + call sm_angle (90.) + call sm_putlabel (5,array) + call sm_angle (0.) + call sm_ltype (1) + call sm_lweight (0.8) + call sm_grid (0,0) + call sm_ltype (0) + + +c*****plot the computed flux curve points + call sm_expand (1.0) + call defcolor (2) + style(1) = 240.7 + call sm_ptype (style,1) + call sm_points (waveplot,flxplt,ntot) + call defcolor (1) + call sm_relocate ((xhi+xlo)/2.0,ylo+0.07*(yhi-ylo)) + call sm_putlabel (5,moditle) + + +c*****compute total flux and effective temperature; exit normally + do i=1,ntot + wavep(i) = 1.0d-8*wavep(i) + enddo + first = fluxp(1) + fluxtot = rinteg(wavep,fluxp,dummy3,ntot,first) + teff = (3.14159*fluxtot/5.67d-5)**0.25 + write (smitle,1001) fluxtot, teff + call defcolor (5) + call sm_relocate ((xhi+xlo)/2.0,ylo+0.14*(yhi-ylo)) + call sm_putlabel (5,smitle) + return + + +c*****format statements +1001 format ('total flux = ' ,1pd12.4, 5x, 'Teff = ', 0pf6.0) + end + + + + diff --git a/Gammabark.f b/Gammabark.f new file mode 100755 index 0000000..94a697e --- /dev/null +++ b/Gammabark.f @@ -0,0 +1,103 @@ + + subroutine gammabark +c****************************************************************************** +c This subroutine pulls in damping factors from Barklem data +c So far, these data have been compiled from: +c 1. Barklem, P. S., Piskunov, N., & O'Mara, B. J. 2000, +c A&ApS, 142, 467 for (mostly) neutral species +c 2. Barklem, P. S., & Aspelund-Johansson, J. 2005, A&Ap, +c 435, 373 for Fe II lines with E_lower < 70000 cm-1 +c Added column to Barklem.dat for radiative damping, Gamma_rad. -AMcW 12/2013 +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Pstuff.com' + include 'Atmos.com' + include 'Linex.com' + include 'Dampdat.com' + data firstread/0/ + character*80 line + + +c*****on first entry to this routine, read damping data from either +c 'Barklem.dat' or 'BarklemUV.dat', depending on the wavelength region +c of the linelist; read Van der Waals params, if radiative damping +c data are present + if (firstread .eq. 0) then + if (wave1(nlines) .gt. 3000.) then + nwant = 35 + else + nwant = 36 + endif + do k=1,30000 + call blankstring (line) + read (nwant,1001,end=10) line + read (line,*) wavebk(k), idbk(k), gammabk(k), alphabk(k) + if (line(34:) .ne. ' ') then + read(line(34:),*) gammarad(k) + else + gammarad(k) = 0.0 + endif + enddo +10 numbark = k -1 + firstread = 1 + endif + + +c*****identify the Barklem list positions of the wavelength limits of +c the input line list + wavemin = 10000000. + do j=1,nlines+nstrong + if (wave1(j) .lt. wavemin) wavemin = wave1(j) + enddo + wavemax = 0. + do j=1,nlines+nstrong + if (wave1(j) .gt. wavemax) wavemax = wave1(j) + enddo + do k=1,numbark + if (wavemin-wavebk(k) .lt. 1.0) then + nummin = k + exit + endif + enddo + do k=nummin,numbark + if (wavebk(k)-wavemax .gt. 1.0) then + nummax = k + exit + endif + enddo + + +c*****search for Barklem data + do j=1,nlines+nstrong + gambark(j) = -1. + alpbark(j) = -1. + gamrad(j) = -1. + if (atom1(j) .gt. 100.) cycle + iatom10 = nint(10.*atom1(j)) + do k=nummin,nummax + waveerror = -(wave1(j) - wavebk(k))/wavebk(k) + iii = nint(10.*idbk(k)) + if (dabs(waveerror).lt.5.0d-06 .and. + . iii .eq. iatom10) then + gamrad(j) = gammarad(k) + gambark(j) = 10.**gammabk(k) + alpbark(j) = (1.-alphabk(k))/2. + exit + endif + if (waveerror .gt. 5.0d-06) exit + enddo + enddo + + +c*****exit normally + return + + +c*****format statements +1001 format (a80) + end + + + + diff --git a/Getasci.f b/Getasci.f new file mode 100755 index 0000000..db51339 --- /dev/null +++ b/Getasci.f @@ -0,0 +1,42 @@ + + subroutine getasci (num,line) +c****************************************************************************** +c this routine asks for information, by printing out the +c characters contained in 'array', and returns what the +c user types out in array 'chinfo'. Variable 'num' on input +c is the number of characters in 'message', and on output is +c the number of characters in 'chinfo' +c****************************************************************************** + + include 'Pstuff.com' + + write (chinfo,1005) +1005 format (80(' ')) + + istat = ivmove(line-1,1) + istat = ivcleol() + istat = ivmove(line-1,1) + if (num .lt. 10) then + write (errmess,1001) num +1001 format ('(a',i1,'$)') + else + write (errmess,1002) num +1002 format ('(a',i2,'$)') + endif + write (*,errmess) array + num = 80 - num + if (num .lt. 10) then + write (errmess,1003) num +1003 format ('(a',i1,')') + else + write (errmess,1004) num +1004 format ('(a',i2,')') + endif + read (*,errmess) chinfo + call getcount (num,chinfo) + return + + end + + + diff --git a/Getcount.f b/Getcount.f new file mode 100755 index 0000000..8369a03 --- /dev/null +++ b/Getcount.f @@ -0,0 +1,24 @@ + + subroutine getcount (num,linechars) +c*************************************************************************** +c this routine simply counts the number of characters in the +c ascii array 'linechars' until the first blank is seen; +c it is most useful for discovering the length of a file name. +c*************************************************************************** + + character*80 linechars + integer num + + + do i=num,1,-1 + if (linechars(i:i) .ne. ' ') go to 11 + enddo + num = -1 + return +11 num = i + + + return + end + + diff --git a/Getnum.f b/Getnum.f new file mode 100755 index 0000000..6b19e43 --- /dev/null +++ b/Getnum.f @@ -0,0 +1,24 @@ + + subroutine getnum (nchars,line,xnum,xnumsngl) +c****************************************************************************** +c this routine gets a double precision number 'xnum' and its +c equivalent single precision number 'xnumsngl' from screen input; +c if a non-number is typed in, the user will be queried again +c****************************************************************************** + + implicit real*8 (a-h,o-z) + real*8 xnum + real*4 xnumsngl + integer line + + + xnum = -9999. +1 call getasci (nchars,line) + if (nchars .lt. 0) return + call number (nchars,line,xnum) + if (xnum .eq. -9999.) go to 1 + xnumsngl = sngl(xnum) + return + + end + diff --git a/Getsyns.f b/Getsyns.f new file mode 100755 index 0000000..40380fd --- /dev/null +++ b/Getsyns.f @@ -0,0 +1,126 @@ + + subroutine getsyns (lscreen,ncall) +c****************************************************************************** +c This routine commands the syntheses to be done (or resyntheses if +c abundances or isotopic ratios are changed) +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Factor.com' + include 'Dummy.com' + + +c*****if the syntheses need to be redone: first rewind the output files, +c then close/reopen line list(s), then rewrite model atmosphere output + if (choice .eq. 'n') then + call chabund + if (choice .eq. 'x') call pltspec (lscreen,ncall) + rewind nf1out + rewind nf2out + if (nflines .ne. 0) then + close (unit=nflines) + open (unit=nflines,file=flines,access='sequential', + . form='formatted',blank='null',status='old', + . iostat=jstat,err=10) + endif + if (nfslines .ne. 0) then + close (unit=nfslines) + open (unit=nfslines,file=fslines,access='sequential', + . form='formatted',blank='null',status='old', + . iostat=jstat,err=10) + endif + if (plotopt .ne. 0) then + rewind nf3out + endif + write (nf1out,1002) modtype + if (modprintopt .ge. 1) then + if (modtype .eq. 'begn ' .or. + . modtype .eq. 'BEGN ') write (nf1out,1003) + write (nf1out,1102) moditle + do i=1,ntau + dummy1(i) = dlog10(pgas(i)) + dummy2(i) = dlog10(ne(i)*1.38054d-16*t(i)) + enddo + write (nf1out,1103) wavref,(i,xref(i),tauref(i),t(i), + . dummy1(i), pgas(i),dummy2(i),ne(i), + . vturb(i),i=1,ntau) + write (nf1out,1104) + do i=1,95 + dummy1(i) = dlog10(xabund(i)) + 12.0 + enddo + write (nf1out,1105) (names(i),i,dummy1(i),i=1,95) + write (nf1out,1106) modprintopt, molopt, linprintopt, + . fluxintopt + write (nf1out,1107) (kapref(i),i=1,ntau) + endif + linprintopt = linprintalt + choice = '1' + endif + + +c*****now do the syntheses + if (numpecatom .eq. 0 .or. numatomsyn .eq. 0) then + isynth = 1 + isorun = 1 + nlines = 0 + mode = 3 + call inlines (1) + call eqlib + call nearly (1) + call synspec + else + do n=1,numatomsyn + isynth = n + isorun = n + start = oldstart + sstop = oldstop + mode = 3 + molopt = 2 + call inlines (1) + call eqlib + call nearly (1) + call synspec + linprintopt = 0 + enddo + endif + return + + +c*****a nonsense situation: the line list read in successfully at the +c*****start, but now there is a problem on re-synthesis +10 write (*,1108) + stop + + +c*****format statements +1002 format (13('-'),'MOOG OUTPUT FILE',10('-'), + . '(MOOG version NOV 2019)',13('-')// + . 'THE MODEL TYPE: ',a10) +1003 format (' The Rosseland opacities and optical depths have ', + . 'been read in') +1102 format (/'MODEL ATMOSPHERE HEADER:'/a80/) +1103 format ('INPUT ATMOSPHERE QUANTITIES',10x, + . '(reference wavelength =',f10.2,')'/3x,'i',2x,'xref',3x, + . 'tauref',7x,'T',6x,'logPg',4x,'Pgas',6x,'logPe', + . 5x,'Ne',9x,'Vturb'/ + . (i4,0pf6.2,1pd11.4,0pf9.1,f8.3,1pd11.4,0pf8.3, + . 1pd11.4,d11.2)) +1104 format (/'INPUT ABUNDANCES: (log10 number densities, log H=12)'/ + . ' Default solar abundances: Asplund et al. 2009') +1105 format (5(3x,a2,'(',i2,')=',f5.2)) +1106 format (/'OPTIONS: atmosphere = ',i1,5x,'molecules = ',i1/ + . ' lines = ',i1,5x,'flux/int = ',i1) +1107 format (/'KAPREF ARRAY:'/(6(1pd12.4))) +1108 format ('something odd: linelist was OK initially, now cannot ', + . 'be read; I QUIT!') + + + end + + + + + diff --git a/Gridplo.f b/Gridplo.f new file mode 100755 index 0000000..45a304c --- /dev/null +++ b/Gridplo.f @@ -0,0 +1,90 @@ + + subroutine gridplo +c****************************************************************************** +c This routine plots a spectrum that already has been synthesized +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Pstuff.com' + + +c*****examine the parameter file +1 call params + + +c*****open the files for: raw spectrum depths (as input), smoothed +c spectra (output), and (if desired) IRAF-style smoothed spectra (output) + nf2out = 21 + lscreen = 4 + array = 'RAW SYNTHESES INPUT' + nchars = 19 + call infile ('input ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + if (plotopt .ne. 0) then + nf3out = 22 + lscreen = lscreen + 2 + array = 'SMOOTHED SYNTHESES OUTPUT' + nchars = 25 + call infile ('output ',nf3out,'formatted ',0,nchars, + . f3out,lscreen) + nf5out = 26 + lscreen = lscreen + 2 + array = 'POSTSCRIPT PLOT OUTPUT' + nchars = 22 + call infile ('output ',nf5out,'formatted ',0,nchars, + . f5out,lscreen) + endif + if (plotopt .gt. 1) then + nf6out = 27 + lscreen = lscreen + 2 + array = 'SPECTRUM COMPARISON OUTPUT' + nchars = 27 + call infile ('output ',nf6out,'formatted ',0,nchars, + . f6out,lscreen) + endif + if (iraf .ne. 0) then + nf4out = 23 + lscreen = lscreen + 2 + array = 'IRAF ("rtext") OUTPUT' + nchars = 24 + call infile ('output ',nf4out,'formatted ',0,nchars, + . f4out,lscreen) + endif + + +c*****now plot the spectrum + if (plotopt.eq.2 .and. specfileopt.gt.0) then + nfobs = 33 + lscreen = lscreen + 2 + array = 'THE OBSERVED SPECTRUM' + nchars = 21 + if (specfileopt.eq.1 .or. specfileopt.eq.3) then + call infile ('input ',nfobs,'unformatted',2880,nchars, + . fobs,lscreen) + else + call infile ('input ',nfobs,'formatted ',0,nchars, + . fobs,lscreen) + endif + endif + if (plotopt .ne. 0) then + line = 10 + ncall = 1 + call pltspec (line,ncall) + endif + + +c*****finish + if (control .ne. 'gridend') then + call finish (1) + go to 1 + else + call finish (0) + endif + return + + + end + + + diff --git a/Gridsyn.f b/Gridsyn.f new file mode 100755 index 0000000..aca7e4f --- /dev/null +++ b/Gridsyn.f @@ -0,0 +1,156 @@ + + subroutine gridsyn +c****************************************************************************** +c This program can synthesize multiple sections of spectra for multiple +c input model atmospheres +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Factor.com' + include 'Mol.com' + include 'Linex.com' + include 'Pstuff.com' + + +c*****examine the parameter file +1 call params + linprintopt = linprintalt + + +c*****open the files for: standard output, raw spectrum depths, smoothed +c spectra, and (if desired) IRAF-style smoothed spectra + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = lscreen + 2 + array = 'RAW SYNTHESIS OUTPUT' + nchars = 20 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + if (plotopt .gt. 0) then + nf3out = 22 + lscreen = lscreen + 2 + array = 'SMOOTHED SYNTHESES OUTPUT' + nchars = 25 + call infile ('output ',nf3out,'formatted ',0,nchars, + . f3out,lscreen) + nf5out = 26 + lscreen = lscreen + 2 + array = 'POSTSCRIPT PLOT OUTPUT' + nchars = 22 + call infile ('output ',nf5out,'formatted ',0,nchars, + . f5out,lscreen) + endif + if (plotopt .gt. 1) then + nf6out = 27 + lscreen = lscreen + 2 + array = 'SPECTRUM COMPARISON OUTPUT' + nchars = 27 + call infile ('output ',nf6out,'formatted ',0,nchars, + . f6out,lscreen) + endif + if (iraf .ne. 0) then + nf4out = 23 + lscreen = lscreen + 2 + array = 'IRAF ("rtext") OUTPUT' + nchars = 24 + call infile ('output ',nf4out,'formatted ',0,nchars, + . f4out,lscreen) + endif + + +c*****open and read the model atmosphere file + nfmodel = 30 + lscreen = lscreen + 2 + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****open the line list file and the strong line list file + nflines = 31 + lscreen = lscreen + 2 + array = 'THE LINE LIST' + nchars = 13 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + if (dostrong .gt. 0) then + nfslines = 32 + lscreen = lscreen + 2 + array = 'THE STRONG LINE LIST' + nchars = 20 + call infile ('input ',nfslines,'formatted ',0,nchars, + . fslines,lscreen) + endif + + +c*****do the syntheses + if (numpecatom .eq. 0 .or. numatomsyn .eq. 0) then + isorun = 1 + isynth = 1 + nlines = 0 + mode = 3 + call inlines (1) + call eqlib + call nearly (1) + call synspec + else + do n=1,numatomsyn + isynth = n + isorun = n + start = oldstart + sstop = oldstop + mode = 3 + call inlines (1) + molopt = 2 + call eqlib + call nearly (1) + call synspec + linprintopt = 0 + enddo + endif + + +c*****now plot the spectrum + if (plotopt.eq.2 .and. specfileopt.gt.0) then + nfobs = 33 + lscreen = lscreen + 2 + array = 'THE OBSERVED SPECTRUM' + nchars = 21 + if (plotopt.eq.1 .or. specfileopt.eq.3) then + call infile ('input ',nfobs,'unformatted',2880,nchars, + . fobs,lscreen) + else + call infile ('input ',nfobs,'formatted ',0,nchars, + . fobs,lscreen) + endif + endif + if (plotopt .ne. 0) then + ncall = 1 + call pltspec (lscreen,ncall) + endif + + +c*****finish + if (control .ne. 'gridend') then + call finish (1) + go to 1 + else + call finish (0) + endif + return + + end + + + + + + diff --git a/Infile.f b/Infile.f new file mode 100755 index 0000000..2f8f8da --- /dev/null +++ b/Infile.f @@ -0,0 +1,99 @@ + + subroutine infile (type,iunit,mode,irec,charcount,fname,line) +c****************************************************************************** +c this routine serves to open files for reading, and does minimal +c error checking. +c****************************************************************************** + + include 'Atmos.com' + include 'Pstuff.com' + integer charcount + character type*7,kstat*7,yesno*1,mode*11 + character fname*80 + +c decide on the file status desired + jstat = 0 + if (type .eq. 'input ') then + kstat = 'old ' + elseif (type .eq. 'output ') then + kstat = 'new ' + elseif (type .eq. 'overout') then + kstat = 'unknown' + endif + +c write out the appropriate message about this file +5 nchars = charcount + if (fname .eq. 'optional_output_file') then + return + elseif (fname .eq. 'no_filename_given') then + array(charcount+1:charcount+24) ='; what is the filename? ' + charcount = charcount + 24 + call getasci (charcount,line) + fname = chinfo + else + array(charcount+1:charcount+24) ='; here is the filename: ' + array(charcount+25:79) = fname + charcount = 79 + call putasci (charcount,line) + if (type .ne. 'input ') kstat = 'unknown' + endif + +c open the file specified by the user, earlier or now +6 if (mode .eq. 'formatted ') then + open (unit=iunit,file=fname,access='sequential', + . form=mode,blank='null',status=kstat, + . iostat=jstat,err=10) + else + open (unit=iunit,file=fname,access='direct', + . form=mode,status=kstat,recl=irec, + . iostat=jstat,err=10) + endif + istat = ivmove (line+1,1) + istat = ivcleol () + return + +c here are the file reading error messages; +c if an expected file is not found, 118 is the error code for SunOS, 1018 +c is for Solaris, and 2 is for Redhat Linux operating systems. +10 if (jstat .eq. 118 .or. jstat .eq. 1018 .or. + . jstat .eq. 2) then + write (errmess,1001) jstat + istat = ivwrite (line+2,3,errmess,44) + fname = 'no_filename_given' + charcount = nchars + go to 5 +c if a file is in danger of being over-written, 117 is the error code for +c SunOS, 1017 is for Solaris, and 128 is for Redhat Linux operating systems. + elseif (jstat .eq. 117 .or. jstat .eq. 1017 .or. + . jstat .eq. 128) then + write (errmess,1002) jstat + istat = ivwrite (line+2,3,errmess,41) + read (*,*) yesno + if (yesno .eq. 'y') then + kstat = 'unknown' + go to 6 + else + write (errmess,1003) + istat = ivwrite (line+2,3,errmess,32) + fname = 'no_filename_given' + charcount = nchars + go to 5 + endif + else + write (errmess,1004) jstat + istat = ivwrite (line+2,3,errmess,46) + endif + + +c*****format statements +1001 format ('ERROR ',i4,': FILE DOES NOT EXIST! TRY AGAIN.') +1002 format ('ERROR ',i4,': FILE EXISTS! OVERWRITE (y/n)?') +1003 format ('PLEASE GIVE A DIFFERENT FILENAME') +1004 format ('ERROR ',i4,': UNKNOWN FILE READING ERROR; ABORT!') + + + end + + + + diff --git a/Inlines.f b/Inlines.f new file mode 100755 index 0000000..05df706 --- /dev/null +++ b/Inlines.f @@ -0,0 +1,312 @@ + + subroutine inlines (num) +c****************************************************************************** +c This subroutine reads in the line data +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Dummy.com' + include 'Pstuff.com' + include 'Quants.com' + include 'Factor.com' + real*8 swave1(40), satom1(40), se(40),sgf(40), + . sdampnum(40),sd0(40),swidth(40), scharge(40) + integer n2 + + + if (num .eq. 2) go to 4 + if (num .eq. 6) go to 340 + n1marker = 1 + n2 = 0 + + +c*****decide if certain element abundances need to be modified. + if (numpecatom .gt. 0) then + do iatom=3,95 + xabund(iatom) = 10.**pecabund(iatom,isynth)* + . 10.**abfactor(isynth)*xabu(iatom) + enddo + endif + if (num .ne. 5) then + write (nf1out,1004) + xmetals = abscale + abfactor(isynth) + if (ninetynineflag .eq. 1) then + write (nf1out,1005) xmetals + if (nf2out .gt. 0) write (nf2out,1005) xmetals + else + if (nf2out .gt. 0) write (nf2out,1006) abscale + endif + do j=1,93 + if (pec(j) .gt. 0 ) then + dummy1(j) = dlog10(xabund(j)) + 12.0 + if (dummy1(j) .le. -10.) then + write (nf1out,1008) names(j),dummy1(j) + if (nf2out .gt. 0) + . write (nf2out,1008) names(j),dummy1(j) + else + write (nf1out,1007) names(j),dummy1(j) + if (nf2out .gt. 0) + . write (nf2out,1007) names(j),dummy1(j) + endif + endif + enddo + endif + + +c*****output information about the isotopic ratios + if (numiso .gt. 0) then + write (nf1out,1014) + do i=1,numiso + iiso = isotope(i) + write (nf1out,1015) iiso, isotope(i), isoabund(i,isorun) + if (nf2out .gt. 0) write (nf2out,1015) + . iiso, isotope(i), isoabund(i,isorun) + enddo + endif + + + +c*****Inititalize strong line printing +c if 'printstrong' gt 0 then the strong lines have +c been printed + printstrong = -1 + + if (num .ne. 4) then + rewind nflines + wave = start + read (nflines,1001) linitle + endif + + +c*****read in the strong lines if needed +302 nstrong = 0 + if (dostrong .gt. 0 ) then + rewind nfslines + do j=1,41 + if (linfileopt .eq. 0) then + read (nfslines,1002,end=340) swave1(j),satom1(j),se(j), + . sgf(j),sdampnum(j),sd0(j),swidth(j) + else + read (nfslines,*,end=340) swave1(j),satom1(j),se(j), + . sgf(j),sdampnum(j),sd0(j),swidth(j) + endif + nstrong = nstrong + 1 + iatom = satom1(j) + scharge(j) = 1.0 + dble(int(10.0*(satom1(j) - iatom) + . +0.0001)) + if (scharge(j) .gt. 3.) then + write (*,1003) swave1(i), satom1(i) + stop + endif + enddo + if (nstrong .gt. 40) then + write(*,*) 'STRONG LINE LIST HAS MORE THAN 40 LINES. THIS' + write(*,*) 'IS NOT ALLOWED. I QUIT!' + stop + endif + endif + +340 nlines = 2500 - nstrong + j = 1 +333 if (linfileopt .eq. 0) then + read (nflines,1002,end=311) wave1(j),atom1(j),e(j,1),gf(j), + . dampnum(j),d0(j),width(j) + else + read (nflines,*,end=311) wave1(j),atom1(j),e(j,1),gf(j), + . dampnum(j),d0(j),width(j) + endif + iatom = atom1(j) + charge(j) = 1.0 + dble(int(10.0*(atom1(j) - iatom)+0.0001)) + if (charge(j) .gt. 3.) then + write (*,1003) wave1(j), atom1(j) + stop + endif + if (width(j) .lt. 0.) then + if (control .eq. 'blends ') then + write (*,*) 'BLENDS cannot have negative EWs! I QUIT!' + stop + else + go to 333 + endif + endif + if (iunits .eq. 1) wave1(j) = 1.d+4*wave1(j) + j = j + 1 + if (j .le. nlines) go to 333 +311 nlines = j - 1 + + +c*****append the strong lines here if necessary + if (dostrong .gt. 0) then + do k=1,nstrong + wave1(nlines+k) = swave1(k) + atom1(nlines+k) = satom1(k) + e(nlines+k,1) = se(k) + gf(nlines+k) = sgf(k) + dampnum(nlines+k) = sdampnum(k) + d0(nlines+k) = sd0(k) + width(nlines+k) = swidth(k) + charge(nlines+k) = scharge(k) + enddo + endif + + +c*****here groups of lines for blended features are defined + do j=1,nlines+nstrong + if (wave1(j) .lt. 0.) then + group(j) = 1 + wave1(j) = dabs(wave1(j)) + width(j) = width(j-1) + else + group(j) = 0 + endif + enddo + + +c*****here excitation potentials are changed from cm^-1 to eV, if needed + do j=1,nlines+nstrong + if (e(j,1) .gt. 50.) then + do jj=1,nlines+nstrong + e(jj,1) = 1.2389e-4*e(jj,1) + enddo + exit + endif + enddo + + +c*****here log(gf) values are turned into gf values, if needed + do j=1,nlines+nstrong + if (gfstyle.eq.0 .or. gf(j) .lt. 0) then + do jj=1,nlines+nstrong + gf(jj) = 10.**gf(jj) + enddo + exit + endif + enddo + + +c*****turn log(RW) values and EW values in mA into EW values in A. Stuff +c duplicate EW values of the first line of a blend into all blend members. + do j=1,nlines+nstrong + if (width(j) .lt. 0.) then + width(j) = 10.**width(j)*wave1(j) + else + width(j) = width(j)/1000. + endif + enddo + + +c*****here some parameters for the lines are assigned or calculated; +c there is a block of statements for moleculer lines, +c and a different one for atomic lines + do j=1,nlines+nstrong + iatom = atom1(j) + atom10 = 10.*atom1(j) + e(j,2) = e(j,1) + 1.239d+4/wave1(j) + + +c*****here are the calculations specific to molecular lines + if (iatom .ge. 100) then + call sunder (atom1(j),ia,ib) + if (ia .gt. ib) then + write (*,1010) ia,ib + stop + endif + if (atom10-int(atom10) .le. 0.0) then + amass(j) = xam(ia) + xam(ib) + mas1 = xam(ia) + 0.0000001 + mas2 = xam(ib) + 0.0000001 + else + jat100 = int(100.*(atom10+0.00001)) + mas1 = jat100 - 100*int(atom10) + jat10000 = int(10000.*(atom10+0.00001)) + mas2 = jat10000 - 100*jat100 + if (mas1.gt.mas2 .or. mas1.le.0.0 .or. + . mas2.le.0.0) then + write (*,1011) mas1, mas2 + stop + endif + amass(j) = mas1 + mas2 + endif +c*****use an internal dissociation energy for molecules if the user +c does not read one in + if (d0(j) .eq. 0.) then + do k=1,110 + if (int(datmol(1,k)+0.01) .eq. + . int(atom1(j)+0.01)) then + d0(j) = datmol(2,k) + go to 390 + endif + enddo + write (*,1013) atom1(j) + stop + endif +390 rdmass(j) = mas1*mas2/amass(j) + chi(j,1) = 0. + chi(j,2) = 0. + chi(j,3) = 0. + + +c*****here are the calculations specific to atomic lines + else + if (atom10-int(atom10) .le. 0.0) then + amass(j) = xam(iatom) + else + atom10 = atom10 + 0.00001 + amass(j) = int(1000*(atom10-int(atom10))) + endif + rdmass(j) = 0. + chi(j,1) = xchi1(iatom) + chi(j,2) = xchi2(iatom) + chi(j,3) = xchi3(iatom) + endif + enddo + + +c*****quit the routine normally + if (nlines+nstrong .lt. 2500) then + if (sstop .gt. wave1(nlines)+10.) sstop = wave1(nlines)+10. + endif + lim1line = 1 + return + + +c****prepare to get another chunk of line data +4 n2 = n1marker + lim1line - 1 + n1marker = n2 + rewind nflines + do j=1,n2 + read (nflines,1001) + enddo + start = wave + go to 302 + + +c*****format statements +1001 format (a80) +1002 format (7e10.3) +1003 format ('INPUT STRONG LINE: LAMBDA = ', f10.3, ' AND ID = ', + . f6.1, ' CANNOT BE DONE!'/ + . 'NO TRIPLE OR GREATER IONS; I QUIT!') +1004 format (/'For these computations, some abundances have ', + . ' been altered:') +1005 format ('Changing overall metallicity: ', f6.2, ' dex') +1006 format ('ALL abundances NOT listed below differ ', + . 'from solar by ', f6.2, ' dex') +1007 format ('element ', a2, ': abundance = ', f5.2) +1008 format ('element ', a2, ': abundance = ', f5.1) +1010 format ('ATOMIC NUMBERS IN MOLECULAR NAME (', + . 2i2, ') ARE IN WRONG ORDER'/'I QUIT!!!') +1011 format ('ISOTOPIC MASS NUMBERS IN MOLECULAR NAME (', + . 2i3, ') ARE IN WRONG ORDER OR ARE WEIRD;'/'I QUIT!!!') +1013 format (f6.1, ' IS AN UNKOWN MOLECULE; I QUIT!') +1014 format ('Isotopic Ratios given for this synthesis') +1015 format ('Isotopic Ratio: [', i4, '/', f10.5, '] = ', f10.3) + + + end + + + diff --git a/Inmodel.f b/Inmodel.f new file mode 100755 index 0000000..e4d9e5b --- /dev/null +++ b/Inmodel.f @@ -0,0 +1,439 @@ + + subroutine inmodel +c****************************************************************************** +c This subroutine reads in the model +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Quants.com' + include 'Factor.com' + include 'Dummy.com' + include 'Pstuff.com' + real*8 element(95), logepsilon(95) + real*8 kaprefmass(100) + real*8 bmol(110) + integer nel(7) + character list*80, list2*70 + integer append + data (nel(i),i=1,7)/ 1, 2, 6, 12, 13, 14, 26/ + + +c*****Read in the key word to define the model type + modelnum = modelnum + 1 + rewind nfmodel + read (nfmodel,2001) modtype + write (nf1out,1010) modtype + if (modtype .eq. 'begn ' .or. modtype .eq. 'BEGN ') + . write (nf1out,1011) + + +c*****Read a comment line (usually describing the model) + read (nfmodel,2002) moditle + + +c*****Read the number of depth points + read (nfmodel,2002) list + list2 = list(11:) + read (list2,*) ntau + if (ntau .gt. 100) then + write (array,1012) + call prinfo (10) + stop + endif + + +c*****EITHER: Read in a model from the output of the experimental new +c MARCS code. This modtype is called "NEWMARCS". On each line +c the numbers are: +c tau(5000), t, pe, pgas, rho, model microtrubulent velocity, +c and mean opacity (cm^2/gm) at the reference wavelength (5000A). + if (modtype .eq. 'NEWMARCS ') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),ne(i),pgas(i),rho(i), + . vturb(1),kaprefmass(i) + enddo +c*****OR: Read in a model from the output of the on-line new +c MARCS code. This modtype is called "WEBMARCS". On each line +c the numbers are: +c layer number (not needed), log{tau(Rosseland)} (not needed), +c log{tau(5000)}, depth, t, pe, pgas, prad (not read in) and +c pturb (not read in) + elseif (modtype .eq. 'WEBMARCS') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) k, dummy1(k), tauref(i), dummy2(k), t(i), + . ne(i), pgas(i) + enddo +c*****OR: Read in a model from an alternative form of on-line new +c MARCS code. This modtype is called "WEB2MARC". On each line +c the numbers are: +c atmospheric layer number (not needed), log{tau(5000)}, t, +c log(Pe), log(Pgas), rhox + elseif (modtype .eq. 'WEB2MARC') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) k,tauref(i),t(i),ne(i),pgas(i),rhox(i) + enddo +c OR: Read in a model from the output of the ATLAS code. This +c modtype is called "KURUCZ". On each line the numbers are: +c rhox, t, pgas, ne, and Rosseland mean opacity (cm^2/gm), and +c two numbers not used by MOOG. + elseif (modtype .eq. 'KURUCZ ') then + do i=1,ntau + read (nfmodel,*) rhox(i),t(i),pgas(i),ne(i),kaprefmass(i) + enddo +c OR: Read in a model from the output of the NEXTGEN code. This +c modtype is called "NEXTGEN". These models have tau scaled at a +c specific wavelength that is read in before the model. MOOG will +c need to generate the opacities internally.On each line the numbers +c are: tau, t, pgas, pe, density, mean molecular weight, two numbers +c not used by MOOG, and Rosseland mean opacity (cm^2/gm). + elseif (modtype .eq. 'NEXTGEN ') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),pgas(i),ne(i), rho(i), + . molweight(i), x2, x3, kaprefmass(i) + enddo +c OR: Read in a model from the output of the MARCS code. This modtype +c type is called "BEGN". On each line the numbers are: +c tauross, t, log(pg), log(pe), mol weight, and kappaross. + elseif (modtype .eq. 'BEGN ') then + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),pgas(i),ne(i), + . molweight(i), kaprefmass(i) + enddo +c OR: Read in a model generated from ATLAS, but without accompanying +c opacities. MOOG will need to generate the opacities internally, +c using a reference wavelength that it reads in before the model. + elseif (modtype .eq. 'KURTYPE') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) rhox(i),t(i),pgas(i),ne(i) + enddo +c OR: Read in a model generated from ATLAS, with output generated +c in Padova. The columns are in somewhat different order than normal + elseif (modtype .eq. 'KUR-PADOVA') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),kaprefmass(i), + . ne(i),pgas(i),rho(i) + enddo +c OR: Read in a generic model that has a tau scale at a specific +c wavelength that is read in before the model. +c MOOG will need to generate the opacities internally. + elseif (modtype .eq. 'GENERIC ') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),pgas(i),ne(i) + enddo +c OR: quit in utter confusion if those model types are not specified + else + write (*,1001) + stop + endif + + +c*****Compute other convenient forms of the temperatures + do i=1,ntau + theta(i) = 5040./t(i) + tkev(i) = 8.6171d-5*t(i) + tlog(i) = dlog(t(i)) + enddo + + +c*****Convert from logarithmic Pgas scales, if needed + if (pgas(ntau)/pgas(1) .lt. 10.) then + do i=1,ntau + pgas(i) = 10.0**pgas(i) + enddo + endif + + +c*****Convert from logarithmic Ne scales, if needed + if(ne(ntau)/ne(1) .lt. 20.) then + do i=1,ntau + ne(i) = 10.0**ne(i) + enddo + endif + + +c*****Convert from Pe to Ne, if needed + if(ne(ntau) .lt. 1.0e7) then + do i=1,ntau + ne(i) = ne(i)/1.38054d-16/t(i) + enddo + endif + + +c*****compute the atomic partition functions + do j=1,95 + elem(j) = dble(j) + call partfn (elem(j),j) + enddo + + +c*****Read the microturbulence (either a single value to apply to +c all layers, or a value for each of the ntau layers). +c Conversion to cm/sec from km/sec is done if needed + read (nfmodel,2003) (vturb(i),i=1,6) + if (vturb(2) .ne. 0.) then + read (nfmodel,2003) (vturb(i),i=7,ntau) + else + do i=2,ntau + vturb(i) = vturb(1) + enddo + endif + if (vturb(1) .lt. 100.) then + write (moditle(55:62),1008) vturb(1) + do i=1,ntau + vturb(i) = 1.0e5*vturb(i) + enddo + else + write (moditle(55:62),1008) vturb(1)/1.0e5 + endif + + +c*****Read in the abundance data, storing the original abundances in xabu +c*****The abundances not read in explicity are taken from the default +c*****solar ones contained in array xsolar. + read (nfmodel,2002) list + list2 = list(11:) + read (list2,*) natoms,abscale + write (moditle(63:73),1009) abscale + if(natoms .ne. 0) + . read (nfmodel,*) (element(i),logepsilon(i),i=1,natoms) + xhyd = 10.0**xsolar(1) + xabund(1) = 1.0 + xabund(2) = 10.0**xsolar(2)/xhyd + do i=3,95 + xabund(i) = 10.0**(xsolar(i)+abscale)/xhyd + xabu(i) = xabund(i) + enddo + if (natoms .ne. 0) then + do i=1,natoms + xabund(idint(element(i))) = 10.0**logepsilon(i)/xhyd + xabu(idint(element(i))) = 10.0**logepsilon(i)/xhyd + enddo + endif + +c*****Compute the mean molecular weight, ignoring molecule formation +c in this approximation (maybe make more general some day?) + wtnum = 0. + wtden = 0. + do i=1,95 + wtnum = wtnum + xabund(i)*xam(i) + wtden = wtden + xabund(i) + enddo + wtmol = wtnum/(xam(1)*wtden) + nomolweight = 0 + if (modtype .eq. 'BEGN ' .or. modtype .eq. 'NEXTGEN ') then + nomolweight = 1 + endif + if (nomolweight .ne. 1) then + do i=1,ntau + molweight(i) = wtmol + enddo + endif + +c*****Compute the density + if (modtype .ne. 'NEXTGEN ') then + do i=1,ntau + rho(i) = pgas(i)*molweight(i)*1.6606d-24/(1.38054d-16*t(i)) + enddo + endif + + +c*****Calculate the fictitious number density of hydrogen +c Note: ph = (-b1 + dsqrt(b1*b1 - 4.0*a1*c1))/(2.0*a1) + iatom = 1 + call partfn (dble(iatom),iatom) + do i=1,ntau + th = 5040.0/t(i) + ah2 = 10.0**(-(12.7422+(-5.1137+(0.1145-0.0091*th)*th)*th)) + a1 = (1.0+2.0*xabund(2))*ah2 + b1 = 1.0 + xabund(2) + c1 = -pgas(i) + ph = (-b1/2.0/a1)+dsqrt((b1**2/(4.0*a1*a1))-(c1/a1)) + nhtot(i) = (ph+2.0*ph*ph*ah2)/(1.38054d-16*t(i)) + enddo + + +c*****Molecular equilibrium called here. +c First, a default list of ions and molecules is considered. Then the +c user's list is read in. A check is performed to see if any of these +c species need to be added. If so, then they are appended to the +c default list. The molecular equilibrium routine is then called. +c Certain species are important for continuous opacities and damping +c calculations - these are read from the equilibrium solution and +c saved. + + +c*****Set up the default molecule list + if (molset .eq. 0) then + nmol = 30 + else + nmol = 59 + endif + if (molset .eq. 0) then + do i=1,110 + amol(i) = smallmollist(i) + enddo + elseif (molset .eq. 1) then + do i=1,110 + amol(i) = largemollist(i) + enddo + else + array = 'molset = 0 or 1 only; I quit!' + call putasci (29,6) + stop + endif + + +c*****Read in the names of additional molecules to be used in +c molecular equilibrium if needed. + read (nfmodel,2002,end=101) list + list2 = list(11:) + read (list2,*) moremol + if (moremol .ne. 0) then + read (nfmodel,*) (bmol(i),i=1,moremol) + append = 1 + do k=1,moremol + do l=1,nmol + if (nint(bmol(k)) .eq. nint(amol(l))) + . append = 0 + enddo + if (append .eq. 1) then + nmol = nmol + 1 + amol(nmol) = bmol(k) + endif + append = 1 + enddo + endif + + +c*****do the general molecular equilibrium +101 call eqlib + + +c*****SPECIAL NEEDS: for NEWMARCS models, to convert kaprefs to our units + if (modtype .eq. 'NEWMARCS ') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for KURUCZ models, to create the optical depth array, +c and to convert kaprefs to our units + elseif (modtype .eq. 'KURUCZ ') then + first = rhox(1)*kaprefmass(1) + tottau = rinteg(rhox,kaprefmass,tauref,ntau,first) + tauref(1) = first + do i=2,ntau + tauref(i) = tauref(i-1) + tauref(i) + enddo + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for NEXTGEN models, to convert kaprefs to our units + elseif (modtype .eq. 'NEXTGEN ') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for BEGN models, to convert kaprefs to our units + elseif (modtype .eq. 'BEGN ') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for KURTYPE models, to create internal kaprefs, +c and to compute taurefs from the kaprefs converted to mass units + elseif (modtype .eq. 'KURTYPE ') then + call opacit (1,wavref) + do i=1,ntau + kaprefmass(i) = kapref(i)/rho(i) + enddo + first = rhox(1)*kaprefmass(1) + tottau = rinteg(rhox,kaprefmass,tauref,ntau,first) + tauref(1) = first + do i=2,ntau + tauref(i) = tauref(i-1) + tauref(i) + enddo +c SPECIAL NEEDS: for NEWMARCS models, to convert kaprefs to our units + elseif (modtype .eq. 'KUR-PADOVA') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for generic models, to create internal kaprefs, + elseif (modtype .eq. 'GENERIC ' .or. + . modtype .eq. 'WEBMARCS ' .or. + . modtype .eq. 'WEB2MARC ') then + call opacit (1,wavref) + endif + + +c*****Convert from logarithmic optical depth scales, or vice versa. +c xref will contain the log of the tauref + if(tauref(1) .lt. 0.) then + do i=1,ntau + xref(i) = tauref(i) + tauref(i) = 10.0**xref(i) + enddo + else + do i=1,ntau + xref(i) = dlog10(tauref(i)) + enddo + endif + + +c*****Write information to output files + if (modprintopt .lt. 1) return + write (nf1out,1002) moditle + do i=1,ntau + dummy1(i) = dlog10(pgas(i)) + dummy2(i) = dlog10(ne(i)*1.38054d-16*t(i)) + enddo + write (nf1out,1003) wavref,(i,xref(i),tauref(i),t(i),dummy1(i), + . pgas(i),dummy2(i),ne(i),vturb(i),i=1,ntau) + write (nf1out,1004) + do i=1,95 + dummy1(i) = dlog10(xabund(i)) + 12.0 + enddo + write (nf1out,1005) (names(i),i,dummy1(i),i=1,95) + write (nf1out,1006) modprintopt, molopt, linprintopt, fluxintopt + write (nf1out,1007) (kapref(i),i=1,ntau) + return + + +c*****format statements +2001 format (a10) +2002 format (a80) +2003 format (6d13.0) +1001 format('permitted model types are:'/'KURUCZ, BEGN, ', + . 'KURTYPE, KUR-PADOVA, NEWMARCS, WEBMARCS, NEXTGEN, ', + . 'WEB2MARC, or GENERIC'/ 'MOOG quits!') +1002 format (/'MODEL ATMOSPHERE HEADER:'/a80/) +1003 format ('INPUT ATMOSPHERE QUANTITIES', 10x, + . '(reference wavelength =',f10.2,')'/3x, 'i', 2x, 'xref', + . 3x, 'tauref', 7x, 'T', 6x, 'logPg', 4x, 'Pgas', + . 6x, 'logPe', 5x, 'Ne', 9x, 'Vturb'/ + . (i4, 0pf6.2, 1pd11.4, 0pf9.1, f8.3, 1pd11.4, 0pf8.3, + . 1pd11.4, d11.2)) +1004 format (/'INPUT ABUNDANCES: (log10 number densities, log H=12)'/ + . ' Default solar abundances: Asplund et al. 2009') +1005 format (5(3x,a2, '(',i2,')=', f5.2)) +1006 format (/'OPTIONS: atmosphere = ', i1, 5x, 'molecules = ', i1/ + . ' lines = ', i1, 5x, 'flux/int = ', i1) +1007 format (/'KAPREF ARRAY:'/(6(1pd12.4))) +1008 format ('vt=', f5.2) +1009 format (' M/H=', f5.2) +1010 format (13('-'),'MOOG OUTPUT FILE', 10('-'), + . '(MOOG version NOV 2019)', 13('-')// + . 'THE MODEL TYPE: ', a10) +1011 format (' The Rosseland opacities and optical depths have ', + . 'been read in') +1012 format ('HOUSTON, WE HAVE MORE THAN 100 DEPTH POINTS! I QUIT!') + + + end + diff --git a/Inmodel.new b/Inmodel.new new file mode 100755 index 0000000..31e4337 --- /dev/null +++ b/Inmodel.new @@ -0,0 +1,524 @@ + + subroutine inmodel +c****************************************************************************** +c This subroutine reads in the model +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Quants.com' + include 'Factor.com' + include 'Dummy.com' + include 'Pstuff.com' + real*8 element(95), logepsilon(95) + real*8 kaprefmass(100) + real*8 bmol(110) + integer nel(7) + character list*80, list2*70 + integer append + data (nel(i),i=1,7)/ 1, 2, 6, 12, 13, 14, 26/ + + +c*****Read in the key word to define the model type + modelnum = modelnum + 1 + rewind nfmodel + read (nfmodel,2001) modtype + write (nf1out,1010) modtype + if (modtype .eq. 'begn ' .or. modtype .eq. 'BEGN ') + . write (nf1out,1011) + + +c*****Read a comment line (usually describing the model) + read (nfmodel,2002) moditle + + +c*****Read the number of depth points + read (nfmodel,2002) list + list2 = list(11:) + read (list2,*) ntau + if (ntau .gt. 100) then + write (array,1012) + call prinfo (10) + stop + endif + + +c*****EITHER: Read in a model from the output of the experimental new +c MARCS code. This modtype is called "NEWMARCS". On each line +c the numbers are: +c tau(5000), t, pe, pgas, rho, model microtrubulent velocity, +c and mean opacity (cm^2/gm) at the reference wavelength (5000A). + if (modtype .eq. 'NEWMARCS ') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),ne(i),pgas(i),rho(i), + . vturb(1),kaprefmass(i) + enddo +c*****OR: Read in a model from the output of the on-line new +c MARCS code. This modtype is called "WEBMARCS". On each line +c the numbers are: +c layer number (not needed), log{tau(Rosseland)} (not needed), +c log{tau(5000)}, depth, t, pe, pgas, prad (not read in) and +c pturb (not read in) + elseif (modtype .eq. 'WEBMARCS') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) k, dummy1(k), tauref(i), dummy2(k), t(i), + . ne(i), pgas(i) + enddo +c*****OR: Read in a model from an alternative form of on-line new +c MARCS code. This modtype is called "WEB2MARC". On each line +c the numbers are: +c atmospheric layer number (not needed), log{tau(5000)}, t, +c log(Pe), log(Pgas), rhox + elseif (modtype .eq. 'WEB2MARC') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) k,tauref(i),t(i),ne(i),pgas(i),rhox(i) + enddo +c OR: Read in a model from the output of the ATLAS code. This +c modtype is called "KURUCZ". On each line the numbers are: +c rhox, t, pgas, ne, and Rosseland mean opacity (cm^2/gm), and +c two numbers not used by MOOG. + elseif (modtype .eq. 'KURUCZ ') then + do i=1,ntau + read (nfmodel,*) rhox(i),t(i),pgas(i),ne(i),kaprefmass(i) + enddo +c OR: Read in a model from the output of the NEXTGEN code. This +c modtype is called "NEXTGEN". These models have tau scaled at a +c specific wavelength that is read in before the model. MOOG will +c need to generate the opacities internally.On each line the numbers +c are: tau, t, pgas, pe, density, mean molecular weight, two numbers +c not used by MOOG, and Rosseland mean opacity (cm^2/gm). + elseif (modtype .eq. 'NEXTGEN ') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),pgas(i),ne(i), rho(i), + . molweight(i), x2, x3, kaprefmass(i) + enddo +c OR: Read in a model from the output of the MARCS code. This modtype +c type is called "BEGN". On each line the numbers are: +c tauross, t, log(pg), log(pe), mol weight, and kappaross. + elseif (modtype .eq. 'BEGN ') then + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),pgas(i),ne(i), + . molweight(i), kaprefmass(i) + enddo +c OR: Read in a model generated from ATLAS, but without accompanying +c opacities. MOOG will need to generate the opacities internally, +c using a reference wavelength that it reads in before the model. + elseif (modtype .eq. 'KURTYPE') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) rhox(i),t(i),pgas(i),ne(i) + enddo +c OR: Read in a model generated from ATLAS, with output generated +c in Padova. The columns are in somewhat different order than normal + elseif (modtype .eq. 'KUR-PADOVA') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),kaprefmass(i), + . ne(i),pgas(i),rho(i) + enddo +c OR: Read in a generic model that has a tau scale at a specific +c wavelength that is read in before the model. +c MOOG will need to generate the opacities internally. + elseif (modtype .eq. 'GENERIC ') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),pgas(i),ne(i) + enddo +c OR: quit in utter confusion if those model types are not specified + else + write (*,1001) + stop + endif + + +c*****Compute other convenient forms of the temperatures + do i=1,ntau + theta(i) = 5040./t(i) + tkev(i) = 8.6171d-5*t(i) + tlog(i) = dlog(t(i)) + enddo + + +c*****Convert from logarithmic Pgas scales, if needed + if (pgas(ntau)/pgas(1) .lt. 10.) then + do i=1,ntau + pgas(i) = 10.0**pgas(i) + enddo + endif + + +c*****Convert from logarithmic Ne scales, if needed + if(ne(ntau)/ne(1) .lt. 20.) then + do i=1,ntau + ne(i) = 10.0**ne(i) + enddo + endif + + +c*****Convert from Pe to Ne, if needed + if(ne(ntau) .lt. 1.0e7) then + do i=1,ntau + ne(i) = ne(i)/1.38065d-16/t(i) + enddo + endif + + +c*****compute the atomic partition functions + do j=1,95 + elem(j) = dble(j) + call partfn (elem(j),j) + enddo + + +c*****Read the microturbulence (either a single value to apply to +c all layers, or a value for each of the ntau layers). +c Conversion to cm/sec from km/sec is done if needed + read (nfmodel,2003) (vturb(i),i=1,6) + if (vturb(2) .ne. 0.) then + read (nfmodel,2003) (vturb(i),i=7,ntau) + else + do i=2,ntau + vturb(i) = vturb(1) + enddo + endif + if (vturb(1) .lt. 100.) then + write (moditle(55:62),1008) vturb(1) + do i=1,ntau + vturb(i) = 1.0e5*vturb(i) + enddo + else + write (moditle(55:62),1008) vturb(1)/1.0e5 + endif + + +c*****Read in the abundance data, storing the original abundances in xabu +c*****The abundances not read in explicity are taken from the default +c*****solar ones contained in array xsolar. + read (nfmodel,2002) list + list2 = list(11:) + read (list2,*) natoms,abscale + write (moditle(63:73),1009) abscale + if(natoms .ne. 0) + . read (nfmodel,*) (element(i),logepsilon(i),i=1,natoms) + xhyd = 10.0**xsolar(1) + xabund(1) = 1.0 + xabund(2) = 10.0**xsolar(2)/xhyd + do i=3,95 + xabund(i) = 10.0**(xsolar(i)+abscale)/xhyd + xabu(i) = xabund(i) + enddo + if (natoms .ne. 0) then + do i=1,natoms + xabund(idint(element(i))) = 10.0**logepsilon(i)/xhyd + xabu(idint(element(i))) = 10.0**logepsilon(i)/xhyd + enddo + endif + +c*****Compute the mean molecular weight, ignoring molecule formation +c in this approximation (maybe make more general some day?) + wtnum = 0. + wtden = 0. + do i=1,95 + wtnum = wtnum + xabund(i)*xam(i) + wtden = wtden + xabund(i) + enddo + wtmol = wtnum/(xam(1)*wtden) + nomolweight = 0 + if (modtype .eq. 'BEGN ' .or. modtype .eq. 'NEXTGEN ') then + nomolweight = 1 + endif + if (nomolweight .ne. 1) then + do i=1,ntau + molweight(i) = wtmol + enddo + endif + +c*****Compute the density + if (modtype .ne. 'NEXTGEN ') then + do i=1,ntau + rho(i) = pgas(i)*molweight(i)*1.6606d-24/(1.38065d-16*t(i)) + enddo + endif + + +c*****Calculate the fictitious number density of hydrogen +c Note: ph = (-b1 + dsqrt(b1*b1 - 4.0*a1*c1))/(2.0*a1) + iatom = 1 + call partfn (dble(iatom),iatom) + do i=1,ntau + th = 5040.0/t(i) + ah2 = 10.0**(-(12.7422+(-5.1137+(0.1145-0.0091*th)*th)*th)) + a1 = (1.0+2.0*xabund(2))*ah2 + b1 = 1.0 + xabund(2) + c1 = -pgas(i) + ph = (-b1/2.0/a1)+dsqrt((b1**2/(4.0*a1*a1))-(c1/a1)) + nhtot(i) = (ph+2.0*ph*ph*ah2)/(6666665d-16*t(i)) + enddo + + +c*****Molecular equilibrium called here. +c First, a default list of ions and molecules is considered. Then the +c user's list is read in. A check is performed to see if any of these +c species need to be added. If so, then they are appended to the +c default list. The molecular equilibrium routine is then called. +c Certain species are important for continuous opacities and damping +c calculations - these are read from the equilibrium solution and +c saved. + + +c*****Set up the default molecule list + if (molset .eq. 0) then + nmol = 14 + else + nmol = 58 + endif + if (molset .eq. 0) then + do i=1,110 + amol(i) = smallmollist(i) + enddo + elseif (molset .eq. 1) then + do i=1,110 + amol(i) = largemollist(i) + enddo + else + array = 'molset = 0 or 1 only; I quit!' + call putasci (29,6) + stop + endif + + +c*****Read in the names of additional molecules to be used in +c molecular equilibrium if needed. + read (nfmodel,2002,end=101) list + list2 = list(11:) + read (list2,*) moremol + if (moremol .ne. 0) then + read (nfmodel,*) (bmol(i),i=1,moremol) + append = 1 + do k=1,moremol + do l=1,nmol + if (nint(bmol(k)) .eq. nint(amol(l))) + . append = 0 + enddo + if (append .eq. 1) then + nmol = nmol + 1 + amol(nmol) = bmol(k) + endif + append = 1 + enddo + endif + + +c*****do the general molecular equilibrium +101 call eqlib + + +c*****save the H_2O and CO_2 results in special number density arrays + do jmol=1,nmol + if (nint(amol(jmol)) .eq. 10108) then + do i=1,ntau + xnh2o(i) = xmol(jmol,i) + enddo + elseif (nint(amol(jmol)) .eq. 60808) then + do i=1,ntau + xnco2(i) = xmol(jmol,i) + enddo + endif + enddo + write (*,444) (amol(n),n=1,nmol) +444 format ('amol'/(7f10.1)) + write (*,445) (xmol(n, 1),n=1,nmol) +445 format ('xmol'/(7(1pg10.2))) + write (*,446) (iorder(n),n=1,neq) +446 format ('iorder'/(7i10)) + write (*,447) (xatom(n),n=1,neq) +447 format ('xatom'/(7(1pg10.2))) + write (*,448) (xamol(n, 1),n=1,neq) +448 format ('xamol'/(7(1pg10.2))) + + +c In the number density array "numdens", the elements denoted by +c the first subscripts are named in at the ends of the assignment +c lines; at present these are the only ones needed for continuous +c opacities +c the desired elements are H, He, C, Mg, Al, Si, Fe, along +c with the H_2 molecule + do j=1,7 + do k=1,neq + if (nel(j) .eq. iorder(k)) then + do i=1,ntau + numdens(j,1,i) = xamol(k,i) + enddo + write (*,555) j, k, nel(j), iorder(k), + . (numdens(j,1,i),i=1,ntau) +555 format (4i6/(1p10d10.1)) + exit + endif + enddo + ispec10 = nint(dble(10*nel(j)+1)) + do k=1,nmol + if (ispec10 .eq. nint(10.*amol(k))) then + do i=1,ntau + numdens(j,2,i) = xmol(k,i) + enddo + write (*,555) j, k, nel(j), iorder(k), + . (numdens(j,2,i),i=1,ntau) + exit + endif + enddo + enddo + do k=1,nmol + ispec = 101 + if (ispec .eq. nint(amol(k))) then + do i=1,ntau + numdens(8,1,i) = xmol(k,i) + enddo + exit + endif + enddo +c numdens(1,2,i) = xmol(1,i) H II +c numdens(2,1,i) = xamol(2,i) He I +c numdens(2,2,i) = xmol(2,i) Hi II +c numdens(3,1,i) = xamol(3,i) C I +c numdens(3,2,i) = xmol(3,i) C II +c numdens(4,1,i) = xamol(6,i) Mg I +c numdens(4,2,i) = xmol(6,i) Mg II +c numdens(5,1,i) = xamol(7,i) Al I +c numdens(5,2,i) = xmol(7,i) Al II +c numdens(6,1,i) = xamol(8,i) Si I +c numdens(6,2,i) = xmol(8,i) Si II +c numdens(7,1,i) = xamol(16,i) Fe I +c numdens(7,2,i) = xmol(16,i) Fe II +c numdens(8,1,i) = xmol(17,i) H_2 + write (*,449) (numdens(1,1,i),i=1,ntau) +449 format ('numdens111'/(1p7d10.1)) +c write (*,447) ((numdens(k,2,i),k=1,8),i=1,ntau) + pause + + + + +c*****SPECIAL NEEDS: for NEWMARCS models, to convert kaprefs to our units + if (modtype .eq. 'NEWMARCS ') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for KURUCZ models, to create the optical depth array, +c and to convert kaprefs to our units + elseif (modtype .eq. 'KURUCZ ') then + first = rhox(1)*kaprefmass(1) + tottau = rinteg(rhox,kaprefmass,tauref,ntau,first) + tauref(1) = first + do i=2,ntau + tauref(i) = tauref(i-1) + tauref(i) + enddo + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for NEXTGEN models, to convert kaprefs to our units + elseif (modtype .eq. 'NEXTGEN ') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for BEGN models, to convert kaprefs to our units + elseif (modtype .eq. 'BEGN ') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for KURTYPE models, to create internal kaprefs, +c and to compute taurefs from the kaprefs converted to mass units + elseif (modtype .eq. 'KURTYPE ') then + call opacit (1,wavref) + do i=1,ntau + kaprefmass(i) = kapref(i)/rho(i) + enddo + first = rhox(1)*kaprefmass(1) + tottau = rinteg(rhox,kaprefmass,tauref,ntau,first) + tauref(1) = first + do i=2,ntau + tauref(i) = tauref(i-1) + tauref(i) + enddo +c SPECIAL NEEDS: for NEWMARCS models, to convert kaprefs to our units + elseif (modtype .eq. 'KUR-PADOVA') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for generic models, to create internal kaprefs, + elseif (modtype .eq. 'GENERIC ' .or. + . modtype .eq. 'WEBMARCS ' .or. + . modtype .eq. 'WEB2MARC ') then + call opacit (1,wavref) + endif + + +c*****Convert from logarithmic optical depth scales, or vice versa. +c xref will contain the log of the tauref + if(tauref(1) .lt. 0.) then + do i=1,ntau + xref(i) = tauref(i) + tauref(i) = 10.0**xref(i) + enddo + else + do i=1,ntau + xref(i) = dlog10(tauref(i)) + enddo + endif + + +c*****Write information to output files + if (modprintopt .lt. 1) return + write (nf1out,1002) moditle + do i=1,ntau + dummy1(i) = dlog10(pgas(i)) + dummy2(i) = dlog10(ne(i)*1.38065d-16*t(i)) + enddo + write (nf1out,1003) wavref,(i,xref(i),tauref(i),t(i),dummy1(i), + . pgas(i),dummy2(i),ne(i),vturb(i),i=1,ntau) + write (nf1out,1004) + do i=1,95 + dummy1(i) = dlog10(xabund(i)) + 12.0 + enddo + write (nf1out,1005) (names(i),i,dummy1(i),i=1,95) + write (nf1out,1006) modprintopt, molopt, linprintopt, fluxintopt + write (nf1out,1007) (kapref(i),i=1,ntau) + return + + +c*****format statements +2001 format (a10) +2002 format (a80) +2003 format (6d13.0) +1001 format('permitted model types are:'/'KURUCZ, BEGN, ', + . 'KURTYPE, KUR-PADOVA, NEWMARCS, WEBMARCS, NEXTGEN, ', + . 'WEB2MARC, or GENERIC'/ 'MOOG quits!') +1002 format (/'MODEL ATMOSPHERE HEADER:'/a80/) +1003 format ('INPUT ATMOSPHERE QUANTITIES', 10x, + . '(reference wavelength =',f10.2,')'/3x, 'i', 2x, 'xref', + . 3x, 'tauref', 7x, 'T', 6x, 'logPg', 4x, 'Pgas', + . 6x, 'logPe', 5x, 'Ne', 9x, 'Vturb'/ + . (i4, 0pf6.2, 1pd11.4, 0pf9.1, f8.3, 1pd11.4, 0pf8.3, + . 1pd11.4, d11.2)) +1004 format (/'INPUT ABUNDANCES: (log10 number densities, log H=12)'/ + . ' Default solar abundances: Asplund et al. 2009') +1005 format (5(3x,a2, '(',i2,')=', f5.2)) +1006 format (/'OPTIONS: atmosphere = ', i1, 5x, 'molecules = ', i1/ + . ' lines = ', i1, 5x, 'flux/int = ', i1) +1007 format (/'KAPREF ARRAY:'/(6(1pd12.4))) +1008 format ('vt=', f5.2) +1009 format (' M/H=', f5.2) +1010 format (13('-'),'MOOG OUTPUT FILE', 10('-'), + . '(MOOG version from 01/28/09)', 13('-')// + . 'THE MODEL TYPE: ', a10) +1011 format (' The Rosseland opacities and optical depths have ', + . 'been read in') +1012 format ('HOUSTON, WE HAVE MORE THAN 100 DEPTH POINTS! I QUIT!') + + + end + diff --git a/Invert.f b/Invert.f new file mode 100755 index 0000000..5bc5348 --- /dev/null +++ b/Invert.f @@ -0,0 +1,92 @@ + + subroutine invert(order,a,i,nsiz) +c****************************************************************************** +c This routine inverts an *order,order* matrix *a*. answer is *i* +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + integer order, orde + real*8 a(nsiz,nsiz), i(nsiz,nsiz) + + + do n=1,order + do m=1,order + i(m,n) = 0.0 + enddo + enddo + do j=1,order + i(j,j) = 1.0 + enddo + orde=order-1 + do k=1,orde + kk = k+1 + do j=kk,order + i(j,k) = 0.0 + i(k,j) = 0.0 + enddo + enddo + +c here begins the inversion + do n=1,order + if (n .eq. order) go to 244 + g = a(n,n) + n1 = n+1 + ng = n + do m=n1,order + f = a(m,n) + if (f .gt. g) then + g = f + ng = m + endif + enddo + if (ng .eq. n) go to 244 + do k=1,order + d = i(n,k) + e = i(ng,k) + f = a(n,k) + g = a(ng,k) + i(ng,k) = d + i(n,k) = e + a(ng,k) = f + a(n,k) = g + enddo +244 g = a(n,n) + if (g .eq. 0.0) then + write (nf1out,1001) + return + endif + do k=1,order + a(n,k) = a(n,k)/g + i(n,k) = i(n,k)/g + enddo + if (n .eq. order) go to 27 + do k=n1,order + f = -a(k,n) + do j=1,order + a(k,j) = a(k,j) + f*a(n,j) + i(k,j) = i(k,j)+f*i(n,j) + enddo + enddo + enddo + +27 do jk=1,orde + n = order - jk + 1 + do j=jk,orde + m = order - j + f = -a(m,n) + do k=1,order + a(m,k) = a(m,k) + f*a(n,k) + i(m,k) = i(m,k) + f*i(n,k) + enddo + enddo + enddo + return + + +c*****format statements +1001 format('WARNING: AN UN-INVERTABLE ARRAY HAS BEEN ENCOUNTERED!') + + end + + diff --git a/Jexpint.f b/Jexpint.f new file mode 100755 index 0000000..d67f00d --- /dev/null +++ b/Jexpint.f @@ -0,0 +1,103 @@ + + real*8 function expint(x,n) +c****************************************************************************** +c This routine computes the n'th exponential integral of x +c ******* notice limits on x for this program!!! ****** +c input - x, independent variable (-100. .le. x .le. +100.) +c n, order of desired exponential integral (1 .le. n .le. 8) +c output - expint, the desired result +c jd does not output ex to save moog call re-write +c rex, expf(-x) +c jd +c note returns with e1(0)=0, (not infinity). +c based on the share routine nuexpi, written by j. w. cooley, +c courant institute of mathematical sciences, new york university +c obtained from rudolf loeser +c general compilation of 1 august 1967. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + real*8 tab(20),xint(7) + data xint/1.,2.,3.,4.,5.,6.,7./ + data tab / .2707662555,.2131473101,.1746297218,.1477309984, + 1.1280843565,.1131470205,.1014028126,.0919145454,.0840790292, + 1.0774922515,.0718735405,.0670215610,.0627878642,.0590604044, + 1.0557529077,.0527977953,.0501413386,.0477402600,.0455592945, + 1.0435694088/ + data xsave /0./ +c + if (x.ge.100.) goto 800 + if (x.le.-100.) goto 800 + xu=x + if(xu)603,602,603 + 602 rex=1.d+00 + if(n-1)800,800,801 + 800 expint=0. + goto 777 + 801 expint=1./xint(n-1) + goto 777 + 603 if(xu-xsave)604,503,604 + 604 xsave=xu + xm=-xu + emx = dexp(xm) +c +c select method for computing ei(xm) +c + if(xm-24.5)501,400,400 + 501 if(xm-5.)502,300,300 + 502 if(xm+1.)100,200,200 + 503 eisave=-arg + exsave=emx +c +c now recurse to higher orders +c + if(n-1)507,507,505 + 505 do 506 i=2,n + eisave=(xu*eisave-exsave)/(-xint(i-1)) + 506 continue + 507 expint=eisave + rex=exsave + 777 return +c +c ei(xm) for xm .lt. -1.0 +c hastings polynomial approximation +c + 100 arg=((((((xu+8.573328740 )*xu+18.05901697 )*xu+8.634760893 )*xu + *+.2677737343)/xm)*emx)/((((xu+9.573322345 )*xu+25.63295615 )*xu + *+21.09965308 )*xu+3.958496923 ) + goto 503 +c ei(xm) for -1. .le. xm .lt. 5.0 +c power series expansion about zero + 200 arg=dlog(abs(xm)) + arg=((((((((((((((((.41159050d-14*xm+.71745406d-13)*xm+.76404637d- + *12)*xm+.11395905d-10)*xm+.17540077d-9)*xm+.23002666d-8)*xm+.275360 + *18d-7)*xm+.30588626d-6)*xm+.31003842d-5)*xm+.28346991d-4)*xm+.2314 + *8057d-3)*xm+.0016666574)*xm+.010416668)*xm+.055555572)*xm+.25)*xm+ + *.99999999)*xm+.57721566)+arg + goto 503 +c +c ei(xm) for 5.0 .le. xm .lt. 24.5 +c table look-up and interpolation +c + 300 i=xm+.5 + xzero=i + xdelta=xzero-xm + arg=tab(i-4) + if(xdelta)303,305,303 + 303 y=arg + deltax=xdelta/xzero + power=1./deltax + do 304 i=1,7 + power=power*deltax + y=((y-power/xzero)*xdelta)/xint(i) + arg=arg+y + if(abs(y/arg)-1.d-8)305,304,304 + 304 continue + 305 arg=emx*arg + goto 503 +c ei(xm) for 24.5 .le. xm +c truncated continued fraction + 400 arg=((((xm-15.)*xm+58.)*xm-50.)*emx)/((((xm-16.)*xm+72.)*xm-96.) + **xm+24.) + goto 503 + end diff --git a/Kappa.com b/Kappa.com new file mode 100755 index 0000000..8b3d923 --- /dev/null +++ b/Kappa.com @@ -0,0 +1,23 @@ + +c****************************************************************************** +c this common block holds the internally-stored arrays for continuous +c opacity calculations +c****************************************************************************** + + real*8 aH1(100), aHminus(100) + real*8 aHeminus(100) + real*8 sigel(100), sigH(100), sigH2(100), sigHe(100) + real*8 aC1(100), aMg1(100), aMg2(100), aAl1(100), aSi1(100), + . aSi2(100), aFe1(100) + real*8 evhkt(100) + real*8 freq, freqlg + + common/kappa/aH1, aHminus, + . aHeminus, + . sigel, sigH, sigH2, sigHe, + . aC1, aMg1, aMg2, aAl1, aSi1, + . aSi2, aFe1, + . evhkt, + . freq, freqlg + + diff --git a/Lineabund.f b/Lineabund.f new file mode 100755 index 0000000..9c709ea --- /dev/null +++ b/Lineabund.f @@ -0,0 +1,103 @@ + + subroutine lineabund (abundin) +c****************************************************************************** +c This routine iteratively determines the abundance for a single line; +c for ease and speed of computation the actual changes are done to +c gf-values, and then at the end the adjustment is made to input +c abundance by the amount that the gf had to be changed +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Pstuff.com' + + + lim2 = lim1 + ncurve = 1 + + +c*****find the c-o-g gf that matches the observed RW + gf1(ncurve) = gf(lim1) + rwlgobs = dlog10(width(lim1)/wave1(lim1)) + gfobs = gftab(ntabtot) + do i=2,ntabtot + if (rwtab(i) .gt. rwlgobs) then + gfobs = gftab(i-1) + (gftab(i)-gftab(i-1))* + . (rwlgobs-rwtab(i-1))/(rwtab(i)-rwtab(i-1)) + go to 15 + endif + enddo + + +c*****using the current gf, compute a line and find the c-o-g gf that matches +c*****the computed RW +15 call oneline (1) + rwlgcal = dlog10(w(ncurve)/wave1(lim1)) + gfcal = gftab(ntabtot) + do i=2,ntabtot + if (rwtab(i) .gt. rwlgcal) then + gfcal = gftab(i-1) + (gftab(i)-gftab(i-1))* + . (rwlgcal-rwtab(i-1))/(rwtab(i)-rwtab(i-1)) + go to 20 + endif + enddo + + +c*****are the observed and computed RWs too different? if so, iterate +c*****by adjusting the assumed gf, and recompute the line. +c*****for strong lines, the iterations are slowed down by using the +c*****square root of the proposed gf shift. +20 error = (w(ncurve)-width(lim1))/width(lim1) + ratio = 10.**(gfobs-gfcal) + ncurve = ncurve + 1 + if (dabs(error) .ge. 0.0015 .and. ncurve .lt. 20) then + rwlcomp = dlog10(w(ncurve-1)/wave1(lim1)) + if (rwlcomp .gt. -4.7) then + gf1(ncurve) = gf1(ncurve-1)*dsqrt(ratio) + do i=1,ntau + kapnu0(lim1,i) = kapnu0(lim1,i)*dsqrt(ratio) + enddo + else + gf1(ncurve) = gf1(ncurve-1)*ratio + do i=1,ntau + kapnu0(lim1,i) = kapnu0(lim1,i)*ratio + enddo + endif + go to 15 + endif + + +c*****if the observed and computed RWs are close, do a final gf adjustment +c*****and finish with one more line recomputation + if (ncurve .eq. 30) then + write (nf1out,1001) + write (nf2out,1001) + endif + gf1(ncurve) = gf1(ncurve-1)*ratio + do i=1,ntau + kapnu0(lim1,i) = kapnu0(lim1,i)*ratio + enddo + call oneline (2) + widout(lim1) = w(ncurve) + wid1comp(lim1) = w(1) + diff = dlog10(gf1(ncurve)/gf(lim1)) + abundout(lim1) = abundin + diff + if (ncurve .ne. 1) then + write (nf1out,1002) ncurve + endif + + + return + + +c*****format statements +1001 format ('OH NO! ANOTHER FAILED ITERATION!') +1002 format (' This fit required ',i2,' iterations including ', + . 'a final small adjustment'/) + + + end + + diff --git a/Lineinfo.f b/Lineinfo.f new file mode 100755 index 0000000..bf5a420 --- /dev/null +++ b/Lineinfo.f @@ -0,0 +1,356 @@ + + subroutine lineinfo (number) +c****************************************************************************** +c This routine is an output subroutine for things having to do with +c lines. +c number = 1 gives input line data information +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Dummy.com' + include 'Factor.com' + include 'Pstuff.com' + include 'Quants.com' + real*8 loggf, logstrength + integer ifresh + character*8 molname + character*4 ion(3) + character*1 name*1 + data ifresh /0/ + data ion/' I ', ' II ', ' III'/ + + + go to (1,2,3), number + + +c*****here the line data are output to "standard_out"; all relevant +c drivers use this +c if you don't want any line output, linprintopt=0 will exit the routine + +1 if (linprintopt .lt. 1) return + +c if you want standard output, linprintopt=1 is chosen +c linprintopt>=2 outputs ionization potentials, charges, masses, +c reduced masses for molecules, +c linprintopt>=3 outputs partition functions +c lineprintop =4 outputs line-center opacities + write (nf1out,1001) nlines + if (linprintopt .ge. 2) write (nf1out,1002) + do j=1,nlines + ich = idint(charge(j) + 0.1) + iatom = idint(atom1(j)) + loggf = dlog10(gf(j)) + logstrength = dlog10(strength(j)) + if (iatom .lt. 100) then + if (iunits .eq. 1) then + write (nf1out,1003) j, 1.d-4*wave1(j), names(iatom), + . ion(ich), atom1(j), e(j,1), loggf, damptype(j), + . logstrength, 1000.*width(j) + else + write (nf1out,1004) j, wave1(j), names(iatom), + . ion(ich), atom1(j), e(j,1), loggf, damptype(j), + . logstrength, 1000.*width(j) + endif + if (linprintopt .ge. 2) write (nf1out,1005) + . (chi(j,k),k=1,3), charge(j), amass(j), rdmass(j) + elseif (iatom .lt. 10000) then + call sunder (atom1(j),i1,i2) + if (i1 .eq. 1) then + l = i1 + i1 = i2 + i2 = l + endif + leftovr = idint(10000.*(atom1(j)-iatom)+0.1) + if (i1 .lt. 10) then + read (names(i1),1006) name + write (molname,1007) name,names(i2),leftovr + else + write (molname,1008) names(i1),names(i2),leftovr + endif + if (iunits .eq. 1) then + write (nf1out,1009) j, 1.d-4*wave1(j), molname, + . atom1(j), e(j,1), loggf, damptype(j), + . logstrength, 1000.*width(j) + else + write (nf1out,1010) j, wave1(j), molname, + . atom1(j), e(j,1), loggf, damptype(j), + . logstrength, 1000.*width(j) + endif + if (linprintopt .ge. 2) + . write (nf1out,1005) + . d0(j), (chi(j,k),k=1,2), charge(j), amass(j), + . rdmass(j) + elseif (iatom .lt. 1000000) then + call sunder (atom1(j),i1,i2) + xia = dble(i2) + call sunder (xia,i2,i3) + if (iatom .eq. 10108) then + molname = 'H_2O ' + else + molname = 'CO_2 ' + endif + if (iunits .eq. 1) then + write (nf1out,1009) j, 1.d-4*wave1(j), molname, + . atom1(j), e(j,1), loggf, damptype(j), + . logstrength, 1000.*width(j) + else + write (nf1out,1010) j, wave1(j), molname, + . atom1(j), e(j,1), loggf, damptype(j), + . logstrength, 1000.*width(j) + endif + if (linprintopt .ge. 2) + . write (nf1out,1005) + . d0(j), (chi(j,k),k=1,2), charge(j), amass(j), + . rdmass(j) + endif + enddo + if (start.ne.0.0 .or. sstop.ne.0.0) then + if (iunits .eq. 1) then + write (nf1out,1011) oldstart,oldstop,oldstep,olddelta + else + write (nf1out,1012) start,sstop,step,delta + endif + if (rwlow .ne. 0.) write (nf1out,1013) rwlow, rwhigh, rwstep + endif + if (linprintopt .ge. 3) then + write (nf1out,1014) + do j=1,95 + if (elem(j) .ne. 0.) then + iatom = int(elem(j)) + write (nf1out,1015) iatom, names(iatom), xam(j), + . xchi1(j), xchi2(j), xchi3(j) + do k=1,4 + write (nf1out,1016) k-1,(u(j,k,i),i=1,ntau) + enddo + endif + enddo + endif + if (linprintopt .ge. 4) then + write (nf1out,1001) + do j=1,nlines + write (nf1out,1002) j,(kapnu0(j,i),i=1,ntau) + enddo + endif + return + + +c*****here the STRONG line data are output; MOOG assumes that no +c molecular line can possibly be in this category +2 write (nf1out,2001) nstrong + do j=nlines+1,nlines+nstrong + ich = idint(charge(j) + 0.1) + iatom = idint(atom1(j)) + loggf = dlog10(gf(j)) + logstrength = dlog10(strength(j)) + if (iatom .lt. 100) then + if (iunits .eq. 1) then + write (nf1out,1003) j-nlines,1.d-4*wave1(j),names(iatom), + . ion(ich), atom1(j), e(j,1), loggf, + . damptype(j), logstrength + else + write (nf1out,1004) j-nlines, wave1(j),names(iatom), + . ion(ich), atom1(j), e(j,1), loggf, + . damptype(j), logstrength + endif + else + write (*,2004) iatom + stop + endif + enddo + printstrong = 1 + return + + +c*****results of force-fitting EW to yield abundances are output here +c look here also for the calls to the trend line calculations +3 if (ifresh .eq.0) then + write (nf2out,3001) linitle,moditle + ifresh = 1 + endif + if (cogatom .eq. 0.) then + iatom = iabatom + else + iatom = idint(cogatom) + endif + xab = dlog10(xabund(iatom)) + 12. + ich = idint(charge(lim1obs) + 0.1) + if (atom1(lim1obs) .lt. 100.) then + write (array,3002) names(iatom), ion(ich) ,xab + line = 1 + call prinfo (line) + write (nf2out,*) + write (nf2out,3002) names(iatom), ion(ich), xab + write (array,3003) + line = 2 + call prinfo (line) + write (nf2out,3003) + else + call sunder (atom1(lim1obs),ia,ib) + if (ia .eq. 1) then + l = ia + ia = ib + ib = l + endif + leftovr = idint(10000.*(atom1(lim1obs)-iatom)+0.1) + if (ia .lt. 10) then + read (names(ia),1006) name + write (molname,1007) name,names(ib) + else + write (molname,1008) names(ia),names(ib) + endif + write (array,3004) molname,xab + line = 1 + call prinfo (line) + write (nf2out,*) + write (nf2out,3004) molname,xab + write (array,3005) names(iabatom) + line = 2 + call prinfo (line) + write (nf2out,3005) names(iabatom) + write (array,3006) + line = 3 + call prinfo (line) + write (nf2out,3006) + endif + do l=lim1obs,lim2obs + if (abundout(l) .ne. 999.99) then + diff = abundout(l) - average + else + diff = 999.99 + endif + ew = 1000.*width(l) + rw = dlog10(width(l)/wave1(l)) + loggf = dlog10(gf(l)) + write (array,3007) wave1(l), atom1(l), e(l,1), loggf, + . ew, rw, abundout(l), diff + if (errmess(1:9) .ne. 'stopinfo!') then + line = line + 1 + call prinfo (line) + endif + write (nf2out,3007) wave1(l), atom1(l), e(l,1), loggf, + . ew, rw, abundout(l), diff + enddo + write (array,3008) average, deviate, kount + line = line + 1 + if (errmess(1:9) .ne. 'stopinfo!') call prinfo (line) + write (nf2out,3008) average, deviate, kount + if (kount .gt. 2 .and. deltaep .gt. 1.5) then + write (array,3009) xxm1, xxb1, xxr1 + if (errmess(1:9) .ne. 'stopinfo!') then + line = line + 1 + call prinfo (line) + endif + write (nf2out,3009) xxm1, xxb1, xxr1 + else + write (array,*) 'No statistics done for E.P. trends' + if (errmess(1:9) .ne. 'stopinfo!') then + line = line + 1 + call prinfo (line) + endif + write (nf2out,*) 'No statistics done for E.P. trends' + endif + if (kount .gt. 2 .and. deltarw .gt. 0.5) then + write (array,3010) xxm2, xxb2, xxr2 + if (errmess(1:9) .ne. 'stopinfo!') then + line = line + 1 + call prinfo (line) + endif + write (nf2out,3010) xxm2, xxb2, xxr2 + else + write (array,*) 'No statistics done for R.W. trends' + if (errmess(1:9) .ne. 'stopinfo!') then + line = line + 1 + call prinfo (line) + endif + write (nf2out,*) 'No statistics done for R.W. trends' + endif + if (kount .gt. 2 .and. deltawv .gt. 500.) then + write (array,3011) xxm3, xxb3, xxr3 + if (errmess(1:9) .ne. 'stopinfo!') then + line = line + 1 + call prinfo (line) + endif + write (nf2out,3011) xxm3, xxb3, xxr3 + else + write (array,*) 'No statistics done for wavelength trends' + if (errmess(1:9) .ne. 'stopinfo!') then + line = line + 1 + call prinfo (line) + endif + write (nf2out,*) 'No statistics done for wavelength trends' + endif + return + + +c*****format statements +1001 format (/'INPUT LINES DATA FOR ' ,i5, ' LINES'/ + . ' #', 5x, 'wave1', 3x, 'spec', 9x, 'spec#', + . 3x, 'E.P.', 3x, 'loggf', 5x, 'damp', 4x, 'logSTR', + . 5x, 'E.W.') +1002 format (20x, 6x, 'chi1', 4x, 'chi2', 6x, 'chi3', 4x, 'charge', + . 6x, 'mass', 4x, 'rdmass') +1003 format (i4, f10.6, 2x, a2, a4, f13.5, f7.3, f8.3, 2x, a7, + . f9.1, f9.2) +1004 format (i4, f10.3, 2x, a2, a4, f13.5, f7.3, f8.3, 2x, a7, + . f10.2, f8.2) +1005 format (20x, f10.3, f8.3, f10.3, f10.1, f10.2, f10.4) +1006 format (a1) +1007 format (1x,a1,a2,i4) +1008 format (2a2,i4) +1009 format (i4, f10.6, 3x, a4, 1x, f13.5, f7.3, f8.3, 2x, a7, + . f10.2, f8.2) +1010 format (i4, f10.3, 3x, a4, 1x, f13.5, f7.3, f8.3, 2x, a7, + . f10.2, f8.2) +1011 format (/'SYNTHETIC SPECTRUM PARAMETERS (units=1/cm)'/ + . 10x,'start =',f11.3,' ',5x,'stop =',f11.3,' '/ + . 'step size in the spectrum =',f11.4,' '/ + . 'at each point, opacity will include lines' , + . ' within',f11.4,' of the point') +1012 format (/'SYNTHETIC SPECTRUM PARAMETERS (units=A)'/ + . 10x,'start =',f11.3,' ',5x,'stop =',f11.3,' '/ + . 'step size in the spectrum =',f11.3,' '/ + . 'at each point, opacity will include lines' , + . ' within',f11.3,' of the point') +1013 format (/'CURVE-OF-GROWTH PARAMETERS'/ + . 10x,'log(R.W) lower bound =',f7.3, + . 10x,'upper bound =',f7.3/ + . 10x,'step size in the curve =',f7.3) +1014 format (/'PARTITION FUNCTIONS') +1015 format (/'Z =',i2,' (',a2,'), mass=',f8.3,' I.P.s=', 3f7.3) +1016 format (' ionization state = ',i1/(10f8.3)) +2001 format (/'INPUT LINES DATA FOR',i4,' STRONG LINES'/ + . ' #', 5x, 'wave1', 3x, 'spec', 9x, 'spec#', + . 3x, 'E.P.', 3x, 'loggf', 5x, 'damp', 4x, 'logSTR') +2004 format ('SPECIES = ', i5, ' IS A MOLECULE, NOT ALLOWED AS A ', + . 'STRONG LINE; I QUIT!') +3001 format (a80) +3002 format ('Abundance Results for Species ',a2,a4, + . ' (input abundance = ',f7.3,')') +3003 format ('wavelength', 9x, 'ID', 6x, 'EP', 3x, 'logGF', 5x, 'EWin', + . 3x, 'logRWin', 5x, 'abund', 3x, 'delavg') +3004 format ('Abundance Results for Species ',a8, + . ' (input abundance = ',f6.2,')') +3005 format ('From these data, the abundance of ',a2, + . ' will be altered') +3006 format ('wavelength', 9x, 'ID', 6x, 'EP', 3x, 'logGF', 5x, 'EWin', + . 3x, 'logRWin', 5x, 'abund', 3x, 'delavg') +3007 format (f10.3, f11.5, f8.3, f8.3, f9.2, f10.3, f10.3, f9.3) +3008 format ('average abundance = ',f6.3,' std. ', + . 'deviation = ',f6.3,' #lines = ',i3) +3009 format ('E.P. correlation: slope = ',f7.3,' intercept = ', + . f7.3,' corr. coeff. = ',f7.3) +3010 format ('R.W. correlation: slope = ',f7.3,' intercept = ', + . f7.3,' corr. coeff. = ',f7.3) +3011 format ('wav. correl.: slope = ',1pd11.3,' intercept = ', + . 0pf7.3,' corr. coeff. = ',f7.3) + + + + return + end + + + diff --git a/Linex.com b/Linex.com new file mode 100755 index 0000000..44aaf0e --- /dev/null +++ b/Linex.com @@ -0,0 +1,52 @@ + +c****************************************************************************** +c this common block has variables related to the lines. Most +c input quantities typically have single dimensions, while the +c things that are computed for each line at each atmosphere level +c have double dimensions. The variables "a", "dopp", and +c "kapnu0" are often over-written with plotting data, +c so leave them alone or suffer unspeakable programming tortures. +c****************************************************************************** + + real*8 a(2500,100), dopp(2500,100), kapnu0(2500,100) + real*8 gf(2500), wave1(2500), atom1(2500), e(2500,2), + . chi(2500,3), amass(2500), charge(2500), d0(2500), + . dampnum(2500), gf1(2500), width(2500), + . abundout(2500), widout(2500), strength(2500), + . rdmass(2500), gambark(2500), alpbark(2500), + . gamrad(2500), wid1comp(2500) + real*8 kapnu(100), taunu(100), cd(100), sline(100) + real*8 d(5000), dellam(400), w(100), + . rwtab(3000), gftab(3000), gfhold + real*8 delta, start, sstop, step, contnorm, + . oldstart, oldstop, oldstep, olddelta + real*8 rwlow, rwhigh, rwstep, wavestep, cogatom, + . delwave, wave, waveold, st1 + real*8 gammatot, gammav, gammas, gammar + integer group(2500), dostrong, gfstyle, lineflag, molflag, + . lim1, lim2, mode, nlines, nstrong, ndepths, ncurve, + . lim1line, lim2line, n1marker, ntabtot, + . iabatom, iaa, ibb + character*7 damptype(2500) + + common/linex/a, dopp, kapnu0, + . gf, wave1, atom1, e, + . chi, amass, charge, d0, + . dampnum, gf1, width, + . abundout, widout, strength, + . rdmass, gambark, alpbark, + . gamrad, wid1comp, + . kapnu, taunu, cd, sline, + . d, dellam, w, + . rwtab, gftab, gfhold, + . delta, start, sstop, step, contnorm, + . oldstart, oldstop, oldstep, olddelta, + . rwlow, rwhigh, rwstep, wavestep, cogatom, + . delwave, wave, waveold, st1, + . gammatot, gammav, gammas, gammar, + . group, dostrong, gfstyle, lineflag, molflag, + . lim1, lim2, mode, nlines, nstrong, ndepths, ncurve, + . lim1line, lim2line, n1marker, ntabtot, + . iabatom, iaa, ibb + common/lindamp/damptype + diff --git a/Linlimit.f b/Linlimit.f new file mode 100755 index 0000000..9321413 --- /dev/null +++ b/Linlimit.f @@ -0,0 +1,157 @@ + + subroutine linlimit +c****************************************************************************** +c This routine marks the range of lines to be considered in a +c particular line calculations, depending on the type of calculation +c (e.g. synthetic spectrum, single line curve-of-growth, etc.) +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Linex.com' + include 'Pstuff.com' + + + lineflag = 0 +c*****for single-line computations, the line rage is the whole line set; +c this will be called from "ewfind" + if (mode .eq. 1) then + lim1line = 1 + lim2line = nlines + return + + +c*****for deriving abundances from single of lines of one species, delimit +c the lines of that species as the range; called from "abfind" + elseif (mode .eq. 2) then + if (lim2line .eq. nlines) then + if (nlines .eq. 1) then + lim1line = 1 + lim2line = 1 + mode = -1 + else + lim1line = -1 + endif + return + endif + if (lim1line .eq. 0) then + lim1line = 1 + else + lim1line = lim2line + 1 + endif + if (lim1line .eq. nlines) then + lim2line = lim1line + return + else + oldatom = atom1(lim1line) + do j=lim1line+1,nlines + if (atom1(j) .ne. oldatom) then + lim2line = j - 1 + return + endif + enddo + endif + lim2line = nlines + return + + +c*****for spectrum synthesis, find the range of lines to include at each +c wavelength step; called from "synspec"; if requested synthesis +c begins more than 10A blueward or goes on more than 105A redward of the +c linelist limits, the synthesis aborts with a message; + elseif (mode .eq. 3) then + wavelo = wave - delta + wavehi = wave + delta +c requested synthesis too far from linelist limits + if (wavehi .lt. wave1(1)-10.0) then + write (*,1004) + stop + elseif (wavelo .gt. wave1(nlines)+10.0 .and. + . nlines+nstrong .lt. 2500) then + write (*,1005) + stop + endif +c blank synthesis at start or end of requested wavelength range + if (wavehi .lt. wave1(1)) then + lim1line = 1 + lim2line = 1 + lineflag = -1 + return + elseif (wavelo .gt. wave1(nlines)) then + lim1line = nlines + lim2line = nlines + lineflag = -1 + return + endif +c requested synthesis region is at least partially within the line list +c first set the lower synthesis limit; at the beginning of a synthesis +c of with a new chunk of lines, lim1line = 0 + if (lim1line.eq.0 .or. wavelo .lt. wave1(1)) lim1line = 1 + do j=lim1line,nlines + if (wavelo .lt. wave1(j)) then + lim1line = j + exit + endif + enddo +c now set the upper synthesis limit + do j=lim1line,nlines + if (wavehi .lt. wave1(j)) then + lim2line = j - 1 + if (lim1line.eq.lim2line .and. + . wavelo.gt. wave1(lim1line)) then + lineflag = -1 + endif + return + endif + enddo +c here the end of the line list has been reached; decide whether +c to read in more lines + if (nlines+nstrong .eq. 2500) then + lim2line = -1 + else + lim2line = nlines + endif + return + + +c*****for blended line force fits to the EWs, the range is a set of +c lines in a particular blend + elseif (mode .eq. 4) then + if (lim1line .eq. 0) lim1line = 1 + if (group(lim1line) .ne. 0.) then + write (array,1001) + call prinfo (10) + write (array,1002) + call prinfo (11) + stop + endif + if (lim1line .eq. nlines) then + lim2line = lim1line + else + do j=lim1line+1,nlines + if (group(j) .ne. 1) then + lim2line = j - 1 + return + endif + enddo + lim2line = nlines + endif + return + else + write (array,1003) mode + call prinfo (10) + stop + endif + + +c*****format statements +1001 format ('TROUBLE! THE FIRST LINE IN THE GROUP') +1002 format ('DOES NOT DEFINE A NEW GROUP OF LINES! I QUIT!') +1003 format ('mode = ', i3, ' BUT IT MUST BE 1-4 ONLY; I QUIT!') +1004 format ('synthesis begins more than 10A blueward of the', + . ' linelist start; I QUIT!') +1005 format ('synthesis ends more than 10A redward of the', + . ' linelist end; I QUIT!') + + + end + diff --git a/Makefile.macdesk b/Makefile.macdesk new file mode 100755 index 0000000..808cf56 --- /dev/null +++ b/Makefile.macdesk @@ -0,0 +1,53 @@ +# makefile for MOOG with all of the common block assignments; +# this is for my Mac laptop + +# here are the object files +OBJECTS = Abfind.o Abpop.o Abunplot.o Batom.o Begin.o Binary.o \ + Binplot.o Binplotprep.o Blankstring.o Blends.o Bmolec.o Boxit.o \ + Calmod.o Cdcalc.o Chabund.o Cog.o Cogplot.o Cogsyn.o \ + Correl.o Crosscorr.o Curve.o Damping.o Defcolor.o Discov.o \ + Doflux.o Drawcurs.o Eqlib.o Ewfind.o \ + Ewweighted.o Fakeline.o Findtic.o Finish.o \ + Fluxplot.o Gammabark.o Getasci.o Getcount.o Getnum.o Getsyns.o \ + Gridplo.o Gridsyn.o Infile.o Inlines.o Inmodel.o Invert.o \ + Jexpint.o Lineinfo.o Lineabund.o Linlimit.o \ + Makeplot.o Molquery.o Moog.o Mydriver.o \ + Nansi.o Nearly.o Number.o Obshead.o \ + Oneline.o Opaccouls.o OpacHelium.o OpacHydrogen.o \ + Opacit.o Opacmetals.o Opacscat.o Params.o Partfn.o \ + Partnew.o Plotit.o Plotremember.o Pltabun.o Pltcog.o \ + Pltflux.o Pltspec.o Pointcurs.o Prinfo.o Putasci.o Readobs.o \ + Rinteg.o Setmols.o Smooth.o Specplot.o Stats.o Sunder.o Synpop.o \ + Synspec.o Synth.o Tablepop.o Taukap.o Total.o Trudamp.o Ucalc.o \ + Vargauss.o Vmacro.o Voigt.o Wavecalc.o Weedout.o Writenumber.o + +# here are the common files +COMMON = Atmos.com Dummy.com Equivs.com Factor.com Kappa.com Linex.com \ + Mol.com Multistar.com Obspars.com Pstuff.com \ + Quants.com Multimod.com Dampdat.com + +FC = g77 -w + +# the following lines point to some needed libraries +X11LIB = /usr/X11R6/lib +SMLIB = /Applications/scisoft/i386/Packages/sm/lib +AQLIB = /usr/local/scisoft/lib + +# here are the compilation and linking commands +all: MOOG ; + @echo ----------------------------------------------------------------- + @echo + @echo make sure that you have entered the proper parameters + @echo for MOOG into the FORTRAN source driver + @echo routine Moog.f !!!!!!!!!!!! + @echo + @echo ----------------------------------------------------------------- + +MOOG: $(OBJECTS); + $(FC) $(OBJECTS) -o MOOG -L$(X11LIB) -lX11 \ + -L$(SMLIB) -lplotsub -ldevices -lutils -L$(AQLIB) -laquaterm + +$(OBJECTS): $(COMMON) + +clean: + -rm -f *.o MOOG libMOOG.a diff --git a/Makefile.macdesksilent b/Makefile.macdesksilent new file mode 100755 index 0000000..0d98bb6 --- /dev/null +++ b/Makefile.macdesksilent @@ -0,0 +1,53 @@ +# makefile for MOOGSILENT with all of the common block assignments; +# this is for my Mac laptop + +# here are the object files +OBJECTS = Abfind.o Abpop.o Abunplot.o Batom.o Begin.o Binary.o \ + Binplot.o Binplotprep.o Blankstring.o Blends.o Bmolec.o Boxit.o \ + Calmod.o Cdcalc.o Chabund.o Cog.o Cogplot.o Cogsyn.o \ + Correl.o Crosscorr.o Curve.o Damping.o Defcolor.o Discov.o \ + Doflux.o Drawcurs.o Eqlib.o Ewfind.o \ + Ewweighted.o Fakeline.o Findtic.o Finish.o \ + Fluxplot.o Gammabark.o Getasci.o Getcount.o Getnum.o Getsyns.o \ + Gridplo.o Gridsyn.o Infile.o Inlines.o Inmodel.o Invert.o \ + Jexpint.o Lineinfo.o Lineabund.o Linlimit.o \ + Makeplot.o Molquery.o Moog.o Mydriver.o \ + Nansi.o Nearly.o Number.o Obshead.o \ + Oneline.o Opaccouls.o OpacHelium.o OpacHydrogen.o \ + Opacit.o Opacmetals.o Opacscat.o Params.o Partfn.o \ + Partnew.o Plotit.o Plotremember.o Pltabun.o Pltcog.o \ + Pltflux.o Pltspec.o Pointcurs.o Prinfo.o Putasci.o Readobs.o \ + Rinteg.o Setmols.o Smooth.o Specplot.o Stats.o Sunder.o Synpop.o \ + Synspec.o Synth.o Tablepop.o Taukap.o Total.o Trudamp.o Ucalc.o \ + Vargauss.o Vmacro.o Voigt.o Wavecalc.o Weedout.o Writenumber.o + +# here are the common files +COMMON = Atmos.com Dummy.com Equivs.com Factor.com Kappa.com Linex.com \ + Mol.com Multistar.com Obspars.com Pstuff.com \ + Quants.com Multimod.com Dampdat.com + +FC = g77 -w + +# the following lines point to some needed libraries +X11LIB = /usr/X11R6/lib +SMLIB = /Applications/scisoft/i386/Packages/sm/lib +AQLIB = /usr/local/scisoft/lib + +# here are the compilation and linking commands +all: MOOGSILENT ; + @echo ----------------------------------------------------------------- + @echo + @echo make sure that you have entered the proper parameters + @echo for MOOGSILENT into the FORTRAN source driver + @echo routine Moogsilent.f !!!!!!!!!!!! + @echo + @echo ----------------------------------------------------------------- + +MOOGSILENT: $(OBJECTS); + $(FC) $(OBJECTS) -o MOOGSILENT -L$(X11LIB) -lX11 \ + -L$(SMLIB) -lplotsub -ldevices -lutils -L$(AQLIB) -laquaterm + +$(OBJECTS): $(COMMON) + +clean: + -rm -f *.o MOOGSILENT libMOOGSILENT.a diff --git a/Makefile.maclap b/Makefile.maclap new file mode 100755 index 0000000..90ce764 --- /dev/null +++ b/Makefile.maclap @@ -0,0 +1,54 @@ +# makefile for MOOG with all of the common block assignments; +# this is for my Mac laptop + +# here are the object files +OBJECTS = Abfind.o Abpop.o Abunplot.o Batom.o Begin.o Binary.o \ + Binplot.o Binplotprep.o Blankstring.o Blends.o Bmolec.o Boxit.o \ + Calmod.o Cdcalc.o Chabund.o Cog.o Cogplot.o Cogsyn.o \ + Correl.o Crosscorr.o Curve.o Damping.o Defcolor.o Discov.o \ + Doflux.o Drawcurs.o Eqlib.o Ewfind.o \ + Ewweighted.o Fakeline.o Findtic.o Finish.o \ + Fluxplot.o Gammabark.o Getasci.o Getcount.o Getnum.o Getsyns.o \ + Gridplo.o Gridsyn.o Infile.o Inlines.o Inmodel.o Invert.o \ + Jexpint.o Lineinfo.o Lineabund.o Linlimit.o \ + Makeplot.o Molquery.o Moog.o Mydriver.o \ + Nansi.o Nearly.o Number.o Obshead.o \ + Oneline.o Opaccouls.o OpacHelium.o OpacHydrogen.o \ + Opacit.o Opacmetals.o Opacscat.o Params.o Partfn.o \ + Partnew.o Plotit.o Plotremember.o Pltabun.o Pltcog.o \ + Pltflux.o Pltspec.o Pointcurs.o Prinfo.o Putasci.o Readobs.o \ + Rinteg.o Setmols.o Smooth.o Specplot.o Stats.o Sunder.o Synpop.o \ + Synspec.o Synth.o Tablepop.o Taukap.o Total.o Trudamp.o Ucalc.o \ + Vargauss.o Vmacro.o Voigt.o Wavecalc.o Weedout.o Writenumber.o + + +# here are the common files +COMMON = Atmos.com Dummy.com Equivs.com Factor.com Kappa.com Linex.com \ + Mol.com Multistar.com Obspars.com Pstuff.com \ + Quants.com Multimod.com Dampdat.com + +FC = gfortran -std=legacy -w + +# the following lines point to some needed libraries +X11LIB = /usr/X11R6/lib +SMLIB = /usr/local/lib + +# here are the compilation and linking commands +all: MOOG ; + @echo ----------------------------------------------------------------- + @echo + @echo make sure that you have entered the proper parameters + @echo for MOOG into the FORTRAN source driver + @echo routine Moog.f !!!!!!!!!!!! + @echo + @echo ----------------------------------------------------------------- + +MOOG: $(OBJECTS); + $(FC) $(OBJECTS) -o MOOG -L$(X11LIB) -lX11 \ + -L$(SMLIB) -lplotsub -ldevices -lutils +#-L$(AQLIB) -laquaterm + +$(OBJECTS): $(COMMON) + +clean: + -rm -f *.o MOOG libMOOG.a diff --git a/Makefile.maclapsilent b/Makefile.maclapsilent new file mode 100755 index 0000000..21ca029 --- /dev/null +++ b/Makefile.maclapsilent @@ -0,0 +1,53 @@ +# makefile for MOOGSILENT with all of the common block assignments; +# this is for my Mac laptop + +# here are the object files +OBJECTS = Abfind.o Abpop.o Abunplot.o Batom.o Begin.o Binary.o \ + Binplot.o Binplotprep.o Blankstring.o Blends.o Bmolec.o Boxit.o \ + Calmod.o Cdcalc.o Chabund.o Cog.o Cogplot.o Cogsyn.o \ + Correl.o Crosscorr.o Curve.o Damping.o Defcolor.o Discov.o \ + Doflux.o Drawcurs.o Eqlib.o Ewfind.o \ + Ewweighted.o Fakeline.o Findtic.o Finish.o \ + Fluxplot.o Gammabark.o Getasci.o Getcount.o Getnum.o Getsyns.o \ + Gridplo.o Gridsyn.o Infile.o Inlines.o Inmodel.o Invert.o \ + Jexpint.o Lineinfo.o Lineabund.o Linlimit.o \ + Makeplot.o Molquery.o Moogsilent.o Mydriver.o \ + Nansi.o Nearly.o Number.o Obshead.o \ + Oneline.o Opaccouls.o OpacHelium.o OpacHydrogen.o \ + Opacit.o Opacmetals.o Opacscat.o Params.o Partfn.o \ + Partnew.o Plotit.o Plotremember.o Pltabun.o Pltcog.o \ + Pltflux.o Pltspec.o Pointcurs.o Prinfo.o Putasci.o Readobs.o \ + Rinteg.o Setmols.o Smooth.o Specplot.o Stats.o Sunder.o Synpop.o \ + Synspec.o Synth.o Tablepop.o Taukap.o Total.o Trudamp.o Ucalc.o \ + Vargauss.o Vmacro.o Voigt.o Wavecalc.o Weedout.o Writenumber.o + + +# here are the common files +COMMON = Atmos.com Dummy.com Equivs.com Factor.com Kappa.com Linex.com \ + Mol.com Multistar.com Obspars.com Pstuff.com \ + Quants.com Multimod.com Dampdat.com + +FC = gfortran -std=legacy -w + +# the following lines point to some needed libraries +X11LIB = /usr/X11R6/lib +SMLIB = /usr/local/lib + +# here are the compilation and linking commands +all: MOOGSILENT ; + @echo ----------------------------------------------------------------- + @echo + @echo make sure that you have entered the proper parameters + @echo for MOOGSILENT into the FORTRAN source driver + @echo routine Moogsilent.f !!!!!!!!!!!! + @echo + @echo ----------------------------------------------------------------- + +MOOGSILENT: $(OBJECTS); + $(FC) $(OBJECTS) -o MOOGSILENT -L$(X11LIB) -lX11 \ + -L$(SMLIB) -lplotsub -ldevices -lutils + +$(OBJECTS): $(COMMON) + +clean: + -rm -f *.o MOOGSILENT libMOOGSILENT.a diff --git a/Makefile.rh b/Makefile.rh new file mode 100755 index 0000000..428fceb --- /dev/null +++ b/Makefile.rh @@ -0,0 +1,52 @@ +# makefile for MOOG with all of the common block assignments; +# this is for a Redhat linux machine + +# here are the object files +OBJECTS = Abfind.o Abpop.o Abunplot.o Batom.o Begin.o Binary.o \ + Binplot.o Binplotprep.o Blankstring.o Blends.o Bmolec.o Boxit.o \ + Calmod.o Cdcalc.o Chabund.o Cog.o Cogplot.o Cogsyn.o \ + Correl.o Crosscorr.o Curve.o Damping.o Defcolor.o Discov.o \ + Doflux.o Drawcurs.o Eqlib.o Ewfind.o \ + Ewweighted.o Fakeline.o Findtic.o Finish.o \ + Fluxplot.o Gammabark.o Getasci.o Getcount.o Getnum.o Getsyns.o \ + Gridplo.o Gridsyn.o Infile.o Inlines.o Inmodel.o Invert.o \ + Jexpint.o Lineinfo.o Lineabund.o Linlimit.o \ + Makeplot.o Molquery.o Moog.o Mydriver.o \ + Nansi.o Nearly.o Number.o Obshead.o \ + Oneline.o Opaccouls.o OpacHelium.o OpacHydrogen.o \ + Opacit.o Opacmetals.o Opacscat.o Params.o Partfn.o \ + Partnew.o Plotit.o Plotremember.o Pltabun.o Pltcog.o \ + Pltflux.o Pltspec.o Pointcurs.o Prinfo.o Putasci.o Readobs.o \ + Rinteg.o Setmols.o Smooth.o Specplot.o Stats.o Sunder.o Synpop.o \ + Synspec.o Synth.o Tablepop.o Taukap.o Total.o Trudamp.o Ucalc.o \ + Vargauss.o Vmacro.o Voigt.o Wavecalc.o Weedout.o Writenumber.o + +COMMON = Atmos.com Dummy.com Equivs.com Factor.com Kappa.com Linex.com \ + Mol.com Multistar.com Obspars.com Pstuff.com \ + Quants.com Multimod.com Dampdat.com + +CC = cc +FC = f77 -Wall + +# the following lines point to some needed libraries +X11LIB = /usr/X11R6/lib +SMLIB = /opt/local/lib + +# here are the compilation and linking commands +all: MOOG ; + @echo ----------------------------------------------------------------- + @echo + @echo make sure that you have entered the proper parameters + @echo for MOOG into the FORTRAN source driver + @echo routine Moog.f !!!!!!!!!!!! + @echo + @echo ----------------------------------------------------------------- + +MOOG: $(OBJECTS); + $(FC) $(OBJECTS) -o MOOG -L$(X11LIB) -lX11 \ + -L$(SMLIB) -lplotsub -ldevices -lutils + +$(OBJECTS): $(COMMON) + +clean: + -rm -f *.o MOOG libMOOG.a diff --git a/Makefile.rh64 b/Makefile.rh64 new file mode 100755 index 0000000..d0c9a97 --- /dev/null +++ b/Makefile.rh64 @@ -0,0 +1,53 @@ +# makefile for MOOG with all of the common block assignments; +# this is for a 64-bit linux machine + +# here are the object files +OBJECTS = Abfind.o Abpop.o Abunplot.o Batom.o Begin.o Binary.o \ + Binplot.o Binplotprep.o Blankstring.o Blends.o Bmolec.o Boxit.o \ + Calmod.o Cdcalc.o Chabund.o Cog.o Cogplot.o Cogsyn.o \ + Correl.o Crosscorr.o Curve.o Damping.o Defcolor.o Discov.o \ + Doflux.o Drawcurs.o Eqlib.o Ewfind.o \ + Ewweighted.o Fakeline.o Findtic.o Finish.o \ + Fluxplot.o Gammabark.o Getasci.o Getcount.o Getnum.o Getsyns.o \ + Gridplo.o Gridsyn.o Infile.o Inlines.o Inmodel.o Invert.o \ + Jexpint.o Lineinfo.o Lineabund.o Linlimit.o \ + Makeplot.o Molquery.o Moog.o Mydriver.o \ + Nansi.o Nearly.o Number.o Obshead.o \ + Oneline.o Opaccouls.o OpacHelium.o OpacHydrogen.o \ + Opacit.o Opacmetals.o Opacscat.o Params.o Partfn.o \ + Partnew.o Plotit.o Plotremember.o Pltabun.o Pltcog.o \ + Pltflux.o Pltspec.o Pointcurs.o Prinfo.o Putasci.o Readobs.o \ + Rinteg.o Setmols.o Smooth.o Specplot.o Stats.o Sunder.o Synpop.o \ + Synspec.o Synth.o Tablepop.o Taukap.o Total.o Trudamp.o Ucalc.o \ + Vargauss.o Vmacro.o Voigt.o Wavecalc.o Weedout.o Writenumber.o + +# here are the common files +COMMON = Atmos.com Dummy.com Equivs.com Factor.com Kappa.com Linex.com \ + Mol.com Multistar.com Obspars.com Pstuff.com \ + Quants.com Multimod.com Dampdat.com + +CC = cc +FC = gfortran -ff2c -Wall + +# the following lines point to some needed libraries +X11LIB = /usr/lib64 +SMLIB = /astro/apps6/opt/sm-2.4.35/lib + +# here are the compilation and linking commands +all: MOOG ; + @echo ----------------------------------------------------------------- + @echo + @echo make sure that you have entered the proper parameters + @echo for MOOG into the FORTRAN source driver + @echo routine Moog.f !!!!!!!!!!!! + @echo + @echo ----------------------------------------------------------------- + +MOOG: $(OBJECTS); + $(FC) $(OBJECTS) -o MOOG -L$(X11LIB) -lX11 \ + -L$(SMLIB) -lplotsub -ldevices -lutils + +$(OBJECTS): $(COMMON) + +clean: + -rm -f *.o MOOG libMOOG.a diff --git a/Makefile.rh64silent b/Makefile.rh64silent new file mode 100755 index 0000000..9ba8b47 --- /dev/null +++ b/Makefile.rh64silent @@ -0,0 +1,53 @@ +# makefile for MOOGSILENT with all of the common block assignments; +# this is for a 64-bit linux machine + +# here are the object files +OBJECTS = Abfind.o Abpop.o Abunplot.o Batom.o Begin.o Binary.o \ + Binplot.o Binplotprep.o Blankstring.o Blends.o Bmolec.o Boxit.o \ + Calmod.o Cdcalc.o Chabund.o Cog.o Cogplot.o Cogsyn.o \ + Correl.o Crosscorr.o Curve.o Damping.o Defcolor.o Discov.o \ + Doflux.o Drawcurs.o Eqlib.o Ewfind.o \ + Ewweighted.o Fakeline.o Findtic.o Finish.o \ + Fluxplot.o Gammabark.o Getasci.o Getcount.o Getnum.o Getsyns.o \ + Gridplo.o Gridsyn.o Infile.o Inlines.o Inmodel.o Invert.o \ + Jexpint.o Lineinfo.o Lineabund.o Linlimit.o \ + Makeplot.o Molquery.o Moogsilent.o Mydriver.o \ + Nansi.o Nearly.o Number.o Obshead.o \ + Oneline.o Opaccouls.o OpacHelium.o OpacHydrogen.o \ + Opacit.o Opacmetals.o Opacscat.o Params.o Partfn.o \ + Partnew.o Plotit.o Plotremember.o Pltabun.o Pltcog.o \ + Pltflux.o Pltspec.o Pointcurs.o Prinfo.o Putasci.o Readobs.o \ + Rinteg.o Setmols.o Smooth.o Specplot.o Stats.o Sunder.o Synpop.o \ + Synspec.o Synth.o Tablepop.o Taukap.o Total.o Trudamp.o Ucalc.o \ + Vargauss.o Vmacro.o Voigt.o Wavecalc.o Weedout.o Writenumber.o + +# here are the common files +COMMON = Atmos.com Dummy.com Equivs.com Factor.com Kappa.com Linex.com \ + Mol.com Multistar.com Obspars.com Pstuff.com \ + Quants.com Multimod.com Dampdat.com + +CC = cc +FC = gfortran -ff2c -Wall + +# the following lines point to some needed libraries +X11LIB = /usr/lib64 +SMLIB = /astro/apps6/opt/sm-2.4.35/lib + +# here are the compilation and linking commands +all: MOOGSILENT ; + @echo ----------------------------------------------------------------- + @echo + @echo make sure that you have entered the proper parameters + @echo for MOOGSILENT into the FORTRAN source driver + @echo routine Moogsilent.f !!!!!!!!!!!! + @echo + @echo ----------------------------------------------------------------- + +MOOGSILENT: $(OBJECTS); + $(FC) $(OBJECTS) -o MOOGSILENT -L$(X11LIB) -lX11 \ + -L$(SMLIB) -lplotsub -ldevices -lutils + +$(OBJECTS): $(COMMON) + +clean: + -rm -f *.o MOOGSILENT libMOOGSILENT.a diff --git a/Makefile.rhsilent b/Makefile.rhsilent new file mode 100755 index 0000000..d45b554 --- /dev/null +++ b/Makefile.rhsilent @@ -0,0 +1,53 @@ +# makefile for MOOGSILENT with all of the common block assignments; +# this is for a Redhat linux machine + +# here are the object files +OBJECTS = Abfind.o Abpop.o Abunplot.o Batom.o Begin.o Binary.o \ + Binplot.o Binplotprep.o Blankstring.o Blends.o Bmolec.o Boxit.o \ + Calmod.o Cdcalc.o Chabund.o Cog.o Cogplot.o Cogsyn.o \ + Correl.o Crosscorr.o Curve.o Damping.o Defcolor.o Discov.o \ + Doflux.o Drawcurs.o Eqlib.o Ewfind.o \ + Ewweighted.o Fakeline.o Findtic.o Finish.o \ + Fluxplot.o Gammabark.o Getasci.o Getcount.o Getnum.o Getsyns.o \ + Gridplo.o Gridsyn.o Infile.o Inlines.o Inmodel.o Invert.o \ + Jexpint.o Lineinfo.o Lineabund.o Linlimit.o \ + Makeplot.o Molquery.o Moog.o Mydriver.o \ + Nansi.o Nearly.o Number.o Obshead.o \ + Oneline.o Opaccouls.o OpacHelium.o OpacHydrogen.o \ + Opacit.o Opacmetals.o Opacscat.o Params.o Partfn.o \ + Partnew.o Plotit.o Plotremember.o Pltabun.o Pltcog.o \ + Pltflux.o Pltspec.o Pointcurs.o Prinfo.o Putasci.o Readobs.o \ + Rinteg.o Setmols.o Smooth.o Specplot.o Stats.o Sunder.o Synpop.o \ + Synspec.o Synth.o Tablepop.o Taukap.o Total.o Trudamp.o Ucalc.o \ + Vargauss.o Vmacro.o Voigt.o Wavecalc.o Weedout.o Writenumber.o + +# here are the common files +COMMON = Atmos.com Dummy.com Equivs.com Factor.com Kappa.com Linex.com \ + Mol.com Multistar.com Obspars.com Pstuff.com \ + Quants.com Multimod.com Dampdat.com + +CC = cc +FC = f77 -Wall + +# the following lines point to some needed libraries +X11LIB = /usr/X11R6/lib +SMLIB = /opt/local/lib + +# here are the compilation and linking commands +all: MOOGSILENT ; + @echo ----------------------------------------------------------------- + @echo + @echo make sure that you have entered the proper parameters + @echo for MOOGSILENT into the FORTRAN source driver + @echo routine Moogsilent.f !!!!!!!!!!!! + @echo + @echo ----------------------------------------------------------------- + +MOOGSILENT: $(OBJECTS); + $(FC) $(OBJECTS) -o MOOGSILENT -L$(X11LIB) -lX11 \ + -L$(SMLIB) -lplotsub -ldevices -lutils + +$(OBJECTS): $(COMMON) + +clean: + -rm -f *.o MOOGSILENT libMOOGSILENT.a diff --git a/Makeplot.f b/Makeplot.f new file mode 100755 index 0000000..e409124 --- /dev/null +++ b/Makeplot.f @@ -0,0 +1,123 @@ + + subroutine makeplot (lscreen) +c****************************************************************************** +c This subroutine does the plot-package-specific commands to begin +c a plot, then calls the specific plot drawing routine, then ends the +c plot. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Pstuff.com' + integer sm_device, lscreen, nchars + + +c open the plot device: screen terminal + if (plotroutine(1:4) .eq. 'term') then + if (sm_device(smterm) .lt. 0) then + write (array,1001) smterm + istat = ivwrite(lscreen+1,1,array,79) + write (nf1out,1007) array(1:79) + stop + endif + endif + + +c open the plot device: hardcopy sent to printer + if (plotroutine(1:4) .eq. 'hard') then + if (plotroutine(6:9) .eq. 'land') then + if (sm_device('postland') .lt. 0) then + write (array,1002) + istat = ivwrite(lscreen+1,1,array,34) + write (nf1out,1007) array(1:34) + stop + endif + elseif (plotroutine(6:9) .eq. 'port') then + if (sm_device('postport') .lt. 0) then + write (array,1009) + istat = ivwrite(lscreen+1,1,array,34) + write (nf1out,1007) array(1:34) + write (nf1out,1009) + stop + endif + endif + endif + + +c open the plot device: postscript file + if (plotroutine(1:4) .eq. 'file') then + if (f5out .eq. 'optional_output_file') then + array = 'Give the file name for the POSTSRIPT plot image: ' + nchars = 49 + call getasci (nchars,maxline) + f5out = chinfo(1:nchars) + else + nchars = 80 + call getcount (nchars,f5out) + endif + if (plotroutine(6:9) .eq. 'land') then + if (nchars .lt. 10) then + write (errmess,1003) nchars + else + write (errmess,1004) nchars + endif + elseif (plotroutine(6:9) .eq. 'port') then + if (nchars .lt. 10) then + write (errmess,1005) nchars + else + write (errmess,1006) nchars + endif + endif + write (array,errmess) f5out(1:nchars) + if (sm_device(array(1:nchars+13)) .lt. 0) then + write (nf1out,1007) array(1:nchars+9) + istat = ivwrite(lscreen+1,1,array,nchars+9) + stop + endif + endif + + +c issue standard beginning commands + call sm_graphics + call sm_erase + + +c call the routine that makes the desired plot + if (plotroutine(11:14) .eq. 'cog ') then + call cogplot + elseif (plotroutine(11:14) .eq. 'abun') then + call abunplot + elseif (plotroutine(11:14) .eq. 'spec') then + call specplot + elseif (plotroutine(11:14) .eq. 'bin ') then + call binplot + elseif (plotroutine(11:14) .eq. 'flux') then + call fluxplot + endif + + +c issue standard ending commands; exit normally + if (plotroutine(1:4) .eq. 'file') then + f5out = 'optional_output_file' + endif + call sm_gflush + if (plotroutine(1:4).eq.'hard' .or. + . plotroutine(1:4).eq.'file') call sm_hardcopy + call sm_alpha + return + + +c*****format statements +1001 format ('DEVICE OPENING ERROR FOR:',a54) +1002 format ('DEVICE OPENING ERROR FOR: postland') +1009 format ('DEVICE OPENING ERROR FOR: postport') +1007 format (a80) +1003 format ('(13hpostlandfile ,a',i1,'$)') +1004 format ('(13hpostlandfile ,a',i2,'$)') +1005 format ('(13hpostportfile ,a',i1,'$)') +1006 format ('(13hpostportfile ,a',i2,'$)') + + + end + + @@ -0,0 +1,41 @@ +c****************************************************************************** +c this common block carries the data to and from the molecular +c equilibrium calculations; it is also used to hold isotopic +c abundance information +c****************************************************************************** + +c amol = names of the species +c smallmolist = the small set of default molecule names +c largemolist = the large set of default molecule names +c xmol = number density of the species at all atmopshere layers +c iorder = names of elements involved in molecular equilibrium, +c in the order that they are encountered in the species list +c xatom = working array at a particular layer: the number densities +c of neutral atomic species +c patom = working array at a particular layer: the partial pressures +c of neutral atomic species +c pmol = working array at a particular layer: the partial pressures +c of molecules +c xamol = number densities of neutral atomic species at all layers +c const = molecular constants loaded in from Bmolec. +c h2ocoeff = polynomial coefficients for H_2O partition functions +c co2coeff = polynomial coefficients for H_2O partition functions + + + real*8 pmol(110), xmol(110,100), xamol(30,100), + . xatom(30), patom(30), + . amol(110), smallmollist(110), largemollist(110), + . datmol(7,110), const(6,110), + . h2ocoeff(5), co2coeff(5), xnh2o(100), xnco2(100), + . uh2o(100), uco2(100) + integer neq, lev, nmol, natoms, iorder(30), molopt, molset + + + common /mol/ pmol, xmol, xamol, + . xatom, patom, + . amol, smallmollist, largemollist, + . datmol, const, + . h2ocoeff, co2coeff, xnh2o, xnco2, + . uh2o, uco2, + . neq, lev, nmol, natoms, iorder, molopt, molset + diff --git a/Molquery.f b/Molquery.f new file mode 100755 index 0000000..818892c --- /dev/null +++ b/Molquery.f @@ -0,0 +1,89 @@ + + subroutine molquery +c****************************************************************************** +c This routine discovers whether a species being analyzed in EW +c predicting of force-fitting mode is involved in molecular equilibrium +c (=M.E.) calculations as well; the variables is set appropriately +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Linex.com' + include 'Mol.com' + include 'Pstuff.com' + + molflag = 0 + iabatom = int(atom1(lim1obs)+0.0001) + + +c*****the species is an atom: +c*****search for it in the list of elements done in M.E. + if (atom1(lim1line) .lt. 100.) then + if (neq .eq. 0) then + return + else + do n=1,neq + if (iabatom .eq. iorder(n)) molflag = 1 + return + enddo + endif + + +c*****the species is a molecule: +c*****halt if M.E. wasn't done or didn't include this species + else + if (neq .eq. 0) then + lscreen = lscreen + 2 + write (array,1001) iabatom + call prinfo (lscreen) + stop + endif + call sunder(atom1(lim1obs),ia,ib) + iaa = ia + ibb = ib + do n=1,neq + if (ia.eq.iorder(n) .or. ib.eq.iorder(n)) molflag = ia + enddo + if (molflag .eq. 0) then + lscreen = lscreen + 2 + write (array,1002) iabatom + call prinfo (lscreen) + stop + endif + molflag = 1 + +c*****if molecule is a hydride, the non-H element will be varied + if (ia.eq.1 .or. ib.eq.1) then + if (ia .eq. 1) then + iabatom = ib + else + iabatom = ia + endif + + +c*****for other molecules, the user specifies which element will be varied + else + write (array,1003) iabatom + nchars = 56 + call getnum (nchars,ikount+1,xnum,shortnum) + iabatom = int(xnum+0.0001) + + if (iabatom.ne.ia .and. iabatom.ne.ib) then + write (array,1003) + stop + endif + endif + return + endif + + +c*****format statements +1001 format ('YOU FORGOT TO DO MOLECULAR EQUILIBRIUM FOR ', + . 'SPECIES ', i3, '; I QUIT!') +1002 format ('YOUR MOLECULAR EQUILIBRIUM DOES NOT INCLUDE ', + . 'THE ATOMS FOR SPECIES ', i3, '; I QUIT!') +1003 format ('LINES OF SPECIES ', i3, ' ARE NEXT: ', + . ' CHANGE ATOMIC NUMBER? ') + + + end + @@ -0,0 +1,117 @@ + + program moog +c****************************************************************************** +c This is the main driver for MOOG. It reads the parameter +c file and sends MOOG to various controlling subroutines. +c This is the normal interactive version of the code; for batch +c processing without user decisions, run MOOGSILENT instead. +c****************************************************************************** + + include 'Atmos.com' + include 'Pstuff.com' + character yesno*1 + + +c$$$$$$$$$$$$$$$$$$$$$$$$ USER SETUP AREA $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ +c*****in compiling MOOG, here the various machine-specific things are +c declared. First, define the directory where MOOG lives, in order to +c be able to pull in auxiliary data files; executing 'make' will +c generate a reminder of this necessity + write (moogpath,1001) + moogpath = + . '/Users/chris/CODES/moognov2019/' + + +c*****What kind of machine are you using? Possible ones are: +c "mac" = Intel-based Apple Mac +c "pcl" = a PC or desktop running some standard linux like Redhat +c "uni" = a machine running Unix, specifically Sun Solaris + machine = "mac" + + +c*****for x11 terminal types, define the parameters of plotting windows; +c set up an x11 screen geometry and placement that is good for spectrum +c syntheses (long, but not tall); the user should play with the format +c statements for particular machines. + write (smt1,1018) +c now do the same for line abundance trend plots (short but tall). + write (smt2,1017) +c$$$$$$$$$$$$$$$$$$$$$$$ END OF USER SETUP $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ + + +c*****declare this to be the normal interactive version; variable "silent" +c will be queried on all occasions that might call for user input; +c DON'T CHANGE THIS VARIABLE; +c if silent = 'n', the normal interactive MOOG is run; +c if silent = 'y', the non-interactive MOOG is run + silent = 'n' + + +c*****invoke the overall starting routine +1 control = ' ' + call begin + + +c*****use one of the standard driver routines + if (control .eq. 'synplot') then + call plotit + elseif (control .eq. 'synth ') then + call synth + elseif (control .eq. 'cogsyn ') then + call cogsyn + elseif (control .eq. 'blends ') then + call blends + elseif (control .eq. 'abfind ') then + call abfind + elseif (control .eq. 'ewfind ') then + call ewfind + elseif (control .eq. 'cog ') then + call cog + elseif (control .eq. 'calmod ') then + call calmod + elseif (control .eq. 'doflux ') then + call doflux + elseif (control .eq. 'weedout') then + call weedout + elseif (control .eq. 'gridsyn') then + call gridsyn + elseif (control .eq. 'gridplo') then + call gridplo + elseif (control .eq. 'binary ') then + call binary + elseif (control .eq. 'abpop ') then + call abpop + elseif (control .eq. 'synpop ') then + call synpop + + +c*****or, put in your own drivers in the form below.... + elseif (control .eq. 'mine ') then + call mydriver + + +c*****or else you are out of luck! + else + array = 'THIS IS NOT ONE OF THE DRIVERS. TRY AGAIN (y/n)?' + istat = ivwrite (4,3,array,49) + istat = ivmove (3,1) + read (*,*) yesno + if (yesno .eq. 'y') then + go to 1 + else + call finish (0) + endif + endif + + +c*****format statements +1001 format (60(' ')) +1003 format (22x,'MOOG IS CONTROLLED BY DRIVER ',a7) +1017 format ('x11 -bg black -title MOOGplot -geom 700x800+650+000') +1018 format ('x11 -bg black -title MOOGplot -geom 1200x350+20+450') + + + end + + + diff --git a/Moogsilent.f b/Moogsilent.f new file mode 100755 index 0000000..6ae7d95 --- /dev/null +++ b/Moogsilent.f @@ -0,0 +1,113 @@ + + program moogsilent +c****************************************************************************** +c This is the main driver for the non-interactive version of MOOG. +c It reads the parameter file and sends MOOG to various controlling +c subroutines. In this version of MOOG the parameter file must +c be named "batch.par" (because the code cannot stop to ask the +c user to name the parameter file) +c****************************************************************************** + + include 'Atmos.com' + include 'Pstuff.com' + + +c$$$$$$$$$$$$$$$$$$$$$$$$ USER SETUP AREA $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ +c in compiling MOOG, here the various machine-specific things are +c declared. First, define the directory where MOOG lives, in order to +c be able to pull in auxiliary data files; executing 'make' will +c generate a reminder of this + write (moogpath,1001) + moogpath = + . '/Users/chris/CODES/moognov2019/' + + +c*****What kind of machine are you using? Possible ones are: +c "mac" = Intel-based Apple Mac +c "pcl" = a PC or desktop running some standard linux like Redhat +c "uni" = a machine running Unix, specifically Sun Solaris + machine = "mac" + + +c*****for x11 terminal types, define the parameters of plotting windows; +c set up an x11 screen geometry and placement that is good for spectrum +c syntheses (long, but not tall); the user should play with the format +c statements for particular machines. + write (smt1,1018) +c now do the same for line abundance trend plots (short but tall). + write (smt2,1017) +c$$$$$$$$$$$$$$$$$$$$$$$ END OF USER SETUP $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ + + +c*****declare this to be the non-interactive version; variable "silent" +c will be queried on all occasions that might call for user input; +c DON'T CHANGE THIS VARIABLE; +c if silent = 'n', the normal interactive MOOG is run; +c if silent = 'y', the non-interactive MOOG is run + silent = 'y' + + +c*****invoke the overall starting routine + control = ' ' + call begin + + +c*****use one of the standard driver routines ("isotop" is obsolete): + if (control .eq. 'synplot') then + call plotit + elseif (control .eq. 'isoplot') then + call plotit + elseif (control .eq. 'synth ') then + call synth + elseif (control .eq. 'cogsyn ') then + call cogsyn + elseif (control .eq. 'blends ') then + call blends + elseif (control .eq. 'abfind ') then + call abfind + elseif (control .eq. 'ewfind ') then + call ewfind + elseif (control .eq. 'cog ') then + call cog + elseif (control .eq. 'calmod ') then + call calmod + elseif (control .eq. 'isotop ') then + control = 'synth ' + call synth + elseif (control .eq. 'doflux ') then + call doflux + elseif (control .eq. 'weedout') then + call weedout + elseif (control .eq. 'gridsyn') then + call gridsyn + elseif (control .eq. 'gridplo') then + call gridplo + elseif (control .eq. 'binary ') then + call binary + elseif (control .eq. 'abpop ') then + call abpop + elseif (control .eq. 'synpop ') then + call synpop + + +c*****or, put in your own drivers in the form below.... + elseif (control .eq. 'mine ') then + call mydriver + + +c*****or else you are out of luck! + else + array = 'THIS IS NOT ONE OF THE DRIVERS. I QUIT!' + istat = ivwrite (4,3,array,49) + stop + endif + + +c*****format statements +1001 format (60(' ')) +1017 format ('x11 -bg black -title MOOGplot -geom 700x800+650+000') +1018 format ('x11 -bg black -title MOOGplot -geom 1200x400+20+450') + + + end + diff --git a/Multimod.com b/Multimod.com new file mode 100755 index 0000000..eefac16 --- /dev/null +++ b/Multimod.com @@ -0,0 +1,32 @@ +c****************************************************************************** +c this common block carries the data for population syntheses, +c using multiple model calculations +c****************************************************************************** + + + real*8 gfmodtab(100,1000,50), rwmodtab(100,1000,50) + real*8 weightmod(100,1000), fluxmod(100,1000), + . ewmod(1000) + real*8 radius(100), relcount(100) + real*8 elspecial(10), abspecial(100,10) + real*8 isospecial(10), fracspecial(100,10) + real*8 deltangf, rwlgerror + integer nmodcurve(100,1000), modtot, nabs, nisos + + character*80 fmodinput(100), fmodoutput(100), + . modpre, synpre + + + common/multidata/ gfmodtab, rwmodtab, + . weightmod, fluxmod, + . ewmod, + . radius, relcount, + . elspecial, abspecial, + . isospecial, fracspecial, + . deltangf, rwlgerror, + . nmodcurve, modtot, nabs, nisos + + common/multichar/ fmodinput, fmodoutput, + . modpre, synpre + + diff --git a/Multistar.com b/Multistar.com new file mode 100755 index 0000000..af83056 --- /dev/null +++ b/Multistar.com @@ -0,0 +1,20 @@ + +c****************************************************************************** +c this common block is used for storning information that will be +c used in combining spectra of different stars in various ways +c****************************************************************************** + + real*8 binpecabund(2,95,5), binpec(2,95), + . fluxprimary, fluxsecondary, + . lumratio, deltaradvel + integer begin + character*80 modbin(2) + + common/binstuff/ + . binpecabund, binpec, + . fluxprimary, fluxsecondary, + . lumratio, deltaradvel, + . begin + common/binchars/ + . modbin + diff --git a/Mydriver.f b/Mydriver.f new file mode 100755 index 0000000..7008739 --- /dev/null +++ b/Mydriver.f @@ -0,0 +1,13 @@ + + subroutine mydriver +c****************************************************************************** +c This program is a dummy routine now. The user can substitute a new +c driver in its place, for experimental or specialized MOOG use. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + + return + + end + @@ -0,0 +1,184 @@ + + integer function ivcleof(y,x) +c****************************************************************************** +c This routine clears to the end of the screen, beginning with the +c position row=y, column=x. The cursor is then placed at (y,x) +c****************************************************************************** + + include 'Pstuff.com' + character blank*79 + integer y,x,ypos,xpos + + write(blank,1001) +1001 format(79(' ')) + istat = ivwrite(y,x,blank,79) + xpos = 1 + ypos = y + + + do 11 ipos=ypos,maxline + istat = ivmove(ipos,xpos) +11 istat = ivcleol() + istat = ivmove(y,x) +c + ivcleof = 0 + return + end + + + + + + integer function ivwrite(y,x,arr,ccount) +c +c This routine writes out a string of characters from 'arr', +c with the first character beginning at row=y, column=x. The length +c of the string may be at most 79 characters, and this routine +c will not write on the 80th column or the 25th row of the screen. +c + include 'Pstuff.com' + integer y,x,count,ccount + character arr*(*),dummy*80,string(80)*1,esc*1 + equivalence (dummy,string(1)) +c + count = ccount + if (y .gt. maxline .or. x .gt. 79) then + ivwrite = -1 + return + endif +c + esc = char(27) + dummy = arr + count = min0(80-x,count) +c + if (x .lt. 10) then + if (y .lt. 10) then + write (*,1007) esc,y,x,(string(i),i=1,count) +1007 format(1x,a1,'[',i1,';',i1,'H',80a1) + else + write (*,1006) esc,y,x,(string(i),i=1,count) +1006 format(1x,a1,'[',i2,';',i1,'H',80a1) + endif + else + if (y .lt. 10) then + write (*,1005) esc,y,x,(string(i),i=1,count) +1005 format(1x,a1,'[',i1,';',i2,'H',80a1) + else + write (*,1004) esc,y,x,(string(i),i=1,count) +1004 format(1x,a1,'[',i2,';',i2,'H',80a1) + endif + endif +c + ivwrite = 0 + return + end + + + + + + + integer function ivmove(y,x) +c +c This routine moves the cursor to position row=y, column=x. +c It checks to be sure that y does not exceed 'maxline', and x does not +c exceed 79 (the screen limits). +c + include 'Pstuff.com' + integer y,x + character esc*1 +c + if (y .gt. maxline .or. x .gt. 79) then + ivmove = -1 + return + endif +c + esc = char(27) +c + if (x .lt. 10) then + if (y .lt. 10) then + write (*,1007) esc,y,x +1007 format(1x,a1,'[',i1,';',i1,'H') + else + write (*,1006) esc,y,x +1006 format(1x,a1,'[',i2,';',i1,'H') + endif + else + if (y .lt. 10) then + write (*,1005) esc,y,x +1005 format(1x,a1,'[',i1,';',i2,'H') + else + write (*,1004) esc,y,x +1004 format(1x,a1,'[',i2,';',i2,'H') + endif + endif +c + ivmove = 0 + return + end + + + + + + + integer function ivcleol() +c This routine clears to the end of a line, beginning with the current +c cursor position. +c + character*1 esc +c + esc = char(27) + write(*,1001) esc +1001 format(1x,a1,'[K') +c + ivcleol = 0 + return + end + + + + + integer function ivbold(on) +c +c This routine either turns on the bold-face lettering, if on=1, +c or turns it off, if on=0 +c + integer on + character*1 esc +c + esc = char(27) + if(on.eq.1) then + write(*,'(1x,a1,a)') esc,'[1m' + else + write(*,'(1x,a1,a)') esc,'[0m' + endif +c + ivbold = 0 + return + end + + + + + + integer function ivundl(on) +c +c This routine either turns on the underlining of text, if on=1, +c or turns it off. +c + integer on + character*1 esc +c + esc = char(27) + if(on.eq.1) then + write(*,'(1x,a1,a)') esc,'[4m' + else + write(*,'(1x,a1,a)') esc,'[0m' + endif +c + ivundl = 0 + return + end + + diff --git a/Nearly.f b/Nearly.f new file mode 100755 index 0000000..73ca6c8 --- /dev/null +++ b/Nearly.f @@ -0,0 +1,186 @@ + + subroutine nearly (numpass) +c****************************************************************************** +c This routine calculates the quantity 'kapnu0' for each line and +c each tau; this is the line opacity at line center. When kapnu0 is +c multiplied by the voigt function, one gets the line opacity at an +c arbitrary wavelength. Then, the Doppler factor 'dopp' and damping +c parameter 'a' are also computed ('a' is done in a call to another +c routine +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Quants.com' + include 'Linex.com' + include 'Factor.com' + include 'Mol.com' + include 'Dummy.com' + real*8 xnum(100) + integer numpass + equivalence (xnum,dummy1) + + +c*****load in data for damping factors to be computed from the data +c of Barklem, if desired + if (numpass.eq.1 .and. dampingopt.eq.1) call gammabark + + +c*****Locate the atmosphere level where taulam is near 0.5 + if (numpass.eq.1 .or. numpass.eq.3) then + call opacit (2,wave1(1)) + do i=1,ntau + if (taulam(i) .ge. 0.5) go to 180 + enddo +180 jtau5 = i + endif + + +c*****if reading in a new line list, do all lines (numpass=1); +c if iterating "abfind" on a species affected by mol. eq., +c do just that species (numpass=2); if doing a fake line, or +c maybe one line for a special purpose, do just the first line +c in the "list" (numpass=3) + if (numpass .eq. 1) then + j1 = 1 + j2 = nlines + nstrong + elseif (numpass .eq. 2) then + j1 = lim1line + j2 = lim2line + elseif (numpass .eq. 3) then + j1 = 1 + j2 = 1 + endif + + +c*****now make the calculations: set up some parameters + do j=j1,j2 + ich = idint(charge(j) + 0.1) + iatom = atom1(j) + 0.0001 + factoriso = 1.0 + + +c*****compute the Doppler factors + if (numpass.eq.1 .or. numpass.eq.3) then + do i=1,ntau + dopp(j,i) = dsqrt(1.6631d8*t(i)/amass(j)+vturb(i)**2) + enddo + + +c*****compute damping parameters in a separate routine + call damping (j) + endif + + +c*****either: compute lower state number densities for atomic lines; +c q21 is the ion/neutral ratio, etc., and q is the ratio of the total +c to the species of interest; do the Saha equation first, then +c the Boltzmann equation + if (iatom .lt. 100) then + do i=1,ntau + q21 = 4.825d15*u(iatom,2,i)/(u(iatom,1,i)*ne(i))* + . t(i)**1.5*dexp(-chi(j,1)/tkev(i)) + q32 = 4.825d15*u(iatom,3,i)/(u(iatom,2,i)*ne(i))* + . t(i)**1.5*dexp(-chi(j,2)/tkev(i)) + q43 = 4.825d15*u(iatom,4,i)/(u(iatom,3,i)*ne(i))* + . t(i)**1.5*dexp(-chi(j,3)/tkev(i)) + if (neq .ne. 0) then + do n=1,neq + if (iatom .eq. iorder(n)) then + xxnum = xamol(n,i) + if (ich .eq. 1) then + q = 1.0 + elseif (ich .eq. 2) then + q = 1.0/q21 + elseif (ich .eq. 3) then + q = 1.0/(q21*q32) + 1.0/q32 + 1.0 + q43 + endif + xnum(i) = xxnum/q*dexp(-e(j,1)/tkev(i))/ + . u(iatom,ich,i) + endif + enddo + endif + if (ich .eq. 1) then + q = 1.0 + q21 + q32*q21 + q43*q32*q21 + elseif (ich .eq. 2) then + q = 1.0/q21 + 1.0 + q32 + q43*q32 + elseif (ich .eq. 3) then + q = 1.0/(q21*q32) + 1.0/q32 + 1.0 + q43 + endif + if (control .eq. 'abandy') then + xxab = xabund(iatom)*10**deltaabund + else + xxab = xabund(iatom) + endif + xnum(i) = xxab*nhtot(i)/q* + . dexp(-e(j,1)/tkev(i))/u(iatom,ich,i) + enddo + + +c*****or: compute lower state number densities for molecular lines + elseif (iatom .lt. 10000) then + call sunder(atom1(j),iaa,ibb) + do n=1,neq + if(iorder(n) .eq. iaa) ia = n + if(iorder(n) .eq. ibb) ib = n + enddo + do i=1,ntau + psipri = + . 1.38065d-16*t(i)*10.0**(d0(j)*theta(i)-13.670)* + . theta(i)**2.5/ + . (rdmass(j)**1.5*u(iaa,1,i)*u(ibb,1,i)) + xnum(i) = dexp(-e(j,1)/tkev(i))*psipri* + . xamol(ia,i)*xamol(ib,i) + enddo + else + if (iatom .eq. 10108) then + do i=1,ntau + xnum(i) = xnh2o(i)/uh2o(i)*dexp(-e(j,1)/tkev(i)) + enddo + elseif (iatom .eq. 60808) then + do i=1,ntau + xnum(i) = xnco2(i)/uco2(i)*dexp(-e(j,1)/tkev(i)) + enddo + else + write (*,1001) iatom + stop + endif + endif + + +c*****finally, compute line opacities at line centers + if (atom1(j)-float(iatom) .ge. 0.0) then + do n=1,numiso + if (atom1(j) .eq. isotope(n)) then + factoriso = isoabund(n,isorun) + endif + enddo + endif + do i=1,ntau + kapnu0(j,i) = 2.65386d-2*xnum(i)*gf(j)*wave1(j)*1.0d-8/ + . dopp(j,i)*(1.0-dexp(-1.43879d8/ + . (wave1(j)*t(i))))/factoriso + enddo + strength(j) = kapnu0(j,jtau5) + enddo + + +c*****output regular line information, and strong line information +c if appropriate; exit routine normally + if (numpass.eq.1 .or. numpass.eq.3) then + if (linprintopt .ge. 0) then + if (dostrong .gt. 0) call lineinfo (2) + call lineinfo (1) + endif + endif + return + + +c*****format statements +1001 format (i6, 'IS NOT AN ALLOWED TRIATOMIC (H_2O AND CO_2);', + . ' I QUIT!') + + + end + + diff --git a/Number.f b/Number.f new file mode 100755 index 0000000..d6367f5 --- /dev/null +++ b/Number.f @@ -0,0 +1,53 @@ + + subroutine number (nchar,line,xnum) +c****************************************************************************** +c this routine decodes a character string into a double precision +c floating point number +c****************************************************************************** + + include 'Pstuff.com' + real*8 xnum + character form*10 + + +c*****if a carriage return has been hit, return with -9999. + if (nchar .le. 0) then + xnum = -9999. + return + endif + + +c*****set the conversion format + if (nchar .lt. 10) then + write(form,1001) nchar + else + write(form,1002) nchar + endif + + +c*****now do the conversiton to a number + read (unit=chinfo,fmt=form,iostat=ierr,err=100) xnum + return + + +c*****here an error has been detected +100 write (errmess,1004) ierr,chinfo(1:nchar) + nchars = 65 + istat = ivwrite (line,3,errmess,nchars) + xnum = -9999. + return + + +c*****format statements +1001 format('(f',i1,'.0) ') +1002 format('(f',i2,'.0) ') +1004 format ('ERROR IN NUMBER INPUT: ERROR=',i4,5x,'NUMBER=',a20) + + + end + + + + + + diff --git a/Obshead.f b/Obshead.f new file mode 100755 index 0000000..fd3281a --- /dev/null +++ b/Obshead.f @@ -0,0 +1,102 @@ + + subroutine obshead (head,iend,line) +c****************************************************************************** +c this routine decodes the header records of the observed FITS +c spectrum file +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Pstuff.com' + include 'Obspars.com' + include 'Atmos.com' + character head*2880 + + do j=1,36 + k = 80*(j-1) + if (head(k+1:k+8) .eq. 'SIMPLE ') then + if (head(k+30:k+30) .ne. 'T') then + write(array,1029) head(k+1:k+58) + istat = ivwrite (line+2,3,array,79) + go to 1007 + endif + elseif (head(k+1:k+8) .eq. 'BITPIX ') then + read (head(k+1:k+80),1025) ibits + if (ibits .eq. 16) then + nblock = 1440 + elseif (ibits .eq. 32) then + nblock = 720 + elseif (ibits .eq. -32) then + nblock = 720 + else + write(array,1026) ibits + istat = ivwrite (line+2,3,array,32) + go to 1007 + endif + elseif (head(k+1:k+8) .eq. 'NAXIS ') then + read (head(k+1:k+80),1025) naxis + if (naxis .ne. 1) then + write(array,1028) head(k+1:k+58) + go to 1007 + endif + elseif (head(k+1:k+8) .eq. 'NAXIS1 ') then + read (head(k+1:k+80),1025) lount + elseif (head(k+1:k+8) .eq. 'OBJECT ') then + write (obsitle,1027) head(k+12:k+80) + elseif (head(k+1:k+8) .eq. 'BZERO ') then + read (head(k+1:k+80),1024) bzero + elseif (head(k+1:k+8) .eq. 'BSCALE ') then + read (head(k+1:k+80),1024) bscale + elseif ((head(k+1:k+8) .eq. 'W0 ') .or. + . (head(k+1:k+8) .eq. 'CRVAL1 ')) then + read (head(k+1:k+80),1024) disp(1) + elseif ((head(k+1:k+8) .eq. 'WPC ') .or. + . (head(k+1:k+8) .eq. 'CDELT1 ')) then + read (head(k+1:k+80),1024) dval + if (dval .ne. 1.) disp(2) = dval + elseif (head(k+1:k+8) .eq. 'CD1_1 ') then + read (head(k+1:k+80),1024) disp(2) + elseif (head(k+1:k+8) .eq. 'FILENAME') then + write (obsitle(39:80),1023) head(k+12:k+53) + elseif (head(k+1:k+8) .eq. 'HISTORY ') then + if (head(k+24:k+28) .eq. 'DISP=') then + read (head(k+1:k+80),1022) (disp(i),i=1,4) + elseif (head(k+20:k+26) .eq. 'D1,2,3:') then + read (head(k+1:k+80),1042) (disp(i),i=1,3) + elseif (head(k+20:k+26) .eq. 'D4,5,6:') then + read (head(k+1:k+80),1042) (disp(i),i=4,6) + elseif (head(k+20:k+26) .eq. 'D7,8,9:') then + read (head(k+1:k+80),1042) (disp(i),i=7,9) + if (disp(7).ne.0.0 .and. disp(8).eq.0.0 .and. + . disp(9).eq.0.0) then + disp(8) = 1.0 + disp(9) = lount + endif + endif + elseif (head(k+1:k+8) .eq. 'END ') then + iend = 1 + return + endif + enddo + return + + +1007 lount = -1 + return + + +c*****format statements +1022 format(28x,1p4d13.5) +1023 format (a41) +1024 format (10x,d20.10) +1025 format (10x,i20) +1026 format('SORRY: I CANT HANDLE BITPIX=',i4) +1027 format (a68) +1028 format('ILLEGAL NAXIS ENTRY: ',a58) +1029 format('ILLEGAL FILE FORMAT: ',a58) +1042 format(26x,1p3d18.11) + + + end + + + diff --git a/Obspars.com b/Obspars.com new file mode 100755 index 0000000..57f23aa --- /dev/null +++ b/Obspars.com @@ -0,0 +1,12 @@ + +c****************************************************************************** +c this common block is simply to share information between the +c observation input routines +c****************************************************************************** + + real*8 disp(9), bzero, bscale + integer ibits, nblock, naxis, naxis1, byteswap + + common/obspars/disp, bzero, bscale, + . ibits, nblock, naxis, naxis1, byteswap + diff --git a/Oneline.f b/Oneline.f new file mode 100755 index 0000000..4cc6155 --- /dev/null +++ b/Oneline.f @@ -0,0 +1,182 @@ + + subroutine oneline (imode) +c****************************************************************************** +c This routine computes a single line profile +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Dummy.com' + real*8 dinteg(200) + data waveold /0.0/ + + +c*****set an arbitrary maximum # of wavelength points to compute +c the line profile + maxsteps = 100 + + +c*****get started; calculate an initial step size; wavestep only is +c*****used in synpop + if (imode .eq. 0) gf1(ncurve) = gf(lim1) + dellam(1) = 0. + if (wavestep .eq. 0.) then + st1 = wave1(lim1)*dopp(lim1,jtau5)/2.997929e10/5. + st1 = dfloat(ifix(10000.*sngl(st1)))/10000. + else + st1 = wavestep + endif + storig = st1 + + +c*****calculate continuous opacity and intensity/flux at line wavelength + wave = wave1(lim1) + if (abs(wave-waveold) .gt. 30.) then + waveold = wave + call opacit(2,wave) + if (imode.ne.2 .and. modprintopt.ge.2) + . write(nf1out,1002) wave,(kaplam(i),i=1,ntau) + call cdcalc(1) + first = 0.4343*cd(1) + flux = rinteg(xref,cd,dummy1,ntau,first) + if (imode .ne. 2) then + if (iunits .eq. 1) then + write (nf1out,1003) 1.d-4*wave,flux + else + write (nf1out,1004) wave,flux + endif + endif + endif + + +c*****check the wavelength step size; expand/contract as necessary + if (wavestep .eq. 0.) then + wave = wave1(lim1) + call taukap + call cdcalc(2) + first = 0.4343*cd(1) + d(1) = rinteg(xref,cd,dummy1,ntau,first) + do k=1,30 + if (k .eq. 30) then + write (*,1010) wave + stop + endif + wave = wave1(lim1) + 5.*st1 + call taukap + call cdcalc(2) + first = 0.4343*cd(1) + d(2) = rinteg(xref,cd,dummy1,ntau,first) + d2d1 = d(2)/d(1) + if (d2d1 .le. 0.2) then + st1 = st1/1.5 + elseif (d2d1 .le. 0.6) then + st1 = st1/1.2 + elseif (d2d1.gt.0.60 .and. d2d1.lt.0.80) then + if (imode .ne. 2) write (nf1out,1001) lim1, + . 1000.*width(lim1), storig, st1, k + exit + elseif (d2d1 .ge. 0.80) then + st1 = st1*1.6 + elseif (d2d1 .ge. 0.90) then + st1 = st1*2.1 + endif + st1 = dble(idnint(10000.*st1))/10000. + enddo + endif + + +c*****calculate wavelength dependent line quantities, and the line depth +c until the depth is very small in the line wing + wave = wave1(lim1) + do n=1,maxsteps + dellam(n) = (n-1)*st1 + wave = wave1(lim1) + dellam(n) + call taukap + call cdcalc(2) + first = 0.4343*cd(1) + d(n) = rinteg(xref,cd,dummy1,ntau,first) + if (linprintopt.ge.3 .and. n.eq.1 .and. imode.eq.2) then + do i=1,ntau + dummy1(i) = xref(i)*cd(i) + enddo + first = 0. + cdmean = rinteg(xref,dummy1,dummy2,ntau,first)/ + . rinteg(xref,cd,dummy2,ntau,first) + do i=1,ntau + if (cdmean .lt. cd(i)) exit + enddo + write (nf1out,1005) lim1, cdmean, i, xref(i) + do i=1,ntau + if (taunu(i)+taulam(i) .ge. 1.) exit + enddo + write (nf1out,1006) lim1, i, dlog10(tauref(i)), + . dlog10(taulam(i)), dlog10(taunu(i)) + endif + if (d(n)/d(1) .lt. 0.0050) then + ndepths = n + exit + endif + if (n .eq. maxsteps) then + if (d(n).gt.0.001 .and. imode.ne.2) then + write (nf1out,1007) + ndepths = maxsteps + endif + endif + enddo + + +c*****finish the calculation + if (imode .ne. 2) write (nf1out,1008) (d(j),j=1,ndepths) + do n=2,ndepths + d(ndepths+n-1) = d(n) + enddo + d(ndepths) = d(1) + do n=2,ndepths + d(n-1) = d(2*ndepths+1-n) + enddo + dellam(1) = -st1*(ndepths-1) + ndep = 2*ndepths - 1 + do n=2,ndep + dellam(n) = dellam(n-1) + st1 + enddo + first = 2*dellam(ndep)*d(ndep) + w(ncurve) = rinteg(dellam,d,dinteg,ndep,first) + if (imode .ne. 2) then + ew = 1000.0*w(ncurve) + gflog = dlog10(gf1(ncurve)) + rwlog = dlog10(w(ncurve)/wave1(lim1)) + write (nf1out,1009) wave1(lim1), ew, rwlog, gf1(ncurve), gflog + endif + return + + +c*****format statements +1001 format (/'LINE ', i5, ':', 5x, 'observed EW to match: ', f7.2/ + . 16x, 'lambda step initial, final: ', 2f7.4/ + . 16x, 'trials needed to decide this: ', i2) +1002 format (' kaplam from 1 to ntau at wavelength',f10.2/ + 1 (6(1pd12.4))) +1003 format ('AT WAVELENGTH/FREQUENCY =',f11.7, + . ' CONTINUUM FLUX/INTENSITY =',1p,d12.5) +1004 format ('AT WAVELENGTH/FREQUENCY =',f11.3, + . ' CONTINUUM FLUX/INTENSITY =',1p,d12.5) +1005 format (/'LINE ', i5, ':', + . ' weighted mean line contribution function C_d =', + . f6.2/ ' which occurs near level ', i3, + . ' with log tauref = ', f6.2) +1006 format (/'LINE ', i5, ':', + . ' tau(total) is greater than 1 at level',i3/ + . ' logs of tauref, taulam, taunu =', 3f6.2) +1007 format ('WARNING: not enough points to specify the line?') +1008 format (10f7.3) +1009 format ('lambda =',f12.3,5x,'E.W. =',f8.2,' mA.',5x, + . 'log(R.W.) =',f6.2/'gf =',1pd10.3,5x,'log(gf) =', + . 0pf7.2) +1010 format ('CANNOT DECIDE ON LINE WAVELENGTH ', + . 'STEP SIZE FOR', f10.2, ' I QUIT!') +1011 format ('original and final wavelength step size: ', 2f8.4) + + end + + diff --git a/OpacHelium.f b/OpacHelium.f new file mode 100755 index 0000000..b02fc91 --- /dev/null +++ b/OpacHelium.f @@ -0,0 +1,45 @@ + +c****************************************************************************** +c The subroutines needed to calculate the He- b-f and f-f opacities are in +c this file. These are from ATLAS9. +c****************************************************************************** + + + + + + subroutine opacHeminus +c****************************************************************************** +c This routine computes the He- bound-free and free-free opacities. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + save + data freq1 /0./ + + if (freq .ne. freq1) then + freq1 = freq + a1 = 3.397d-46 + (-5.216d-31+7.039d-15/freq)/freq + b1 = -4.116d-42 + ( 1.067d-26+8.135d-11/freq)/freq + cc = 5.081d-37 + (-8.724d-23-5.659d-08/freq)/freq + endif + + do i=1,ntau + aHeminus(i) = (a1*t(i) + b1 +c1/t(i))*ne(i)* + . numdens(2,1,i)/u(2,1,i) + enddo + + return + end + + + + + + + + + + diff --git a/OpacHydrogen.f b/OpacHydrogen.f new file mode 100755 index 0000000..a193fb9 --- /dev/null +++ b/OpacHydrogen.f @@ -0,0 +1,280 @@ +c****************************************************************************** +c The subroutines needed to calculate the H I b-f, H I f-f, H- b-f, and +c H- f-f opacities are in this file. These are from ATLAS9. +c****************************************************************************** + + + + + + subroutine opacH1 +c****************************************************************************** +c This routine computes the H- bound-free and free-free opacities. +c It returns the cross-section times the number density of H- particles. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + include 'Mol.com' + real*8 cont(8), bolt(100,8), exlim(100), freet(100), boltex(100) + save + data modcount/0/ + +c set up some data upon first entrance with a new model atmosphere + if (modelnum .ne. modcount) then + modcount = modelnum + do i=1,ntau + do n=1,8 + xn2 = dfloat(n*n) + bolt(i,n) = dexp(-13.595*(1.-1./xn2)/tkev(i))*2.* + . xn2*numdens(1,1,i)/u(1,1,i) + enddo + freet(i) = ne(i)*numdens(1,2,i)/u(1,2,i)/dsqrt(t(i)) + xr = numdens(1,1,i)/u(1,1,i)*(2./2./13.595)*tkev(i) + boltex(i) = dexp(-13.427/tkev(i))*xr + exlim(i) = dexp(-13.595/tkev(i))*xr + enddo + endif + + do n=1,8 + cont(n) = coulx(n,freq,1.d0) + enddo + + freq3 = freq**3 + cfree = 3.6919d8/freq3 + c = 2.815d29/freq3 + do i=1,ntau + ex = boltex(i) + if (freq .lt. 4.05933d13) ex = exlim(i)/evhkt(i) + h = (cont(7)*bolt(i,7) + cont8*bolt(i,8) + + . (ex - exlim(i))*c + + . coulff(1,tlog(i),freq)*freet(i)*cfree)*(1.-evhkt(i)) + do n=1,6 + h = h + cont(n)*bolt(i,n)*(1.-evhkt(i)) + enddo + aH1(i) = h + enddo + + return + end + + + + + + + subroutine opacHminus +c****************************************************************************** +c This routine computes the H- bound-free and free-free opacities. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + real*8 wbf(85), bf(85), fflog(22,11), ff(11,22) + real*8 ffbeg(11,11), ffend(11,11), fftt(11), wfflog(22) + real*8 fftheta(100), thetaff(11), wavek(22) + real*8 xhmin(100) + equivalence (ff(1,1),ffbeg(1,1)), (ff(1,12),ffend(1,1)) + save +c From Mathisen (1984), after Wishart (1979) and Broad & Reinhardt (1976) + data wbf/ 18.00, 19.60, 21.40, 23.60, 26.40, 29.80, 34.30, + . 40.40, 49.10, 62.60, 111.30, 112.10, 112.67, 112.95, 113.05, + . 113.10, 113.20, 113.23, 113.50, 114.40, 121.00, 139.00, 164.00, + . 175.00, 200.00, 225.00, 250.00, 275.00, 300.00, 325.00, 350.00, + . 375.00, 400.00, 425.00, 450.00, 475.00, 500.00, 525.00, 550.00, + . 575.00, 600.00, 625.00, 650.00, 675.00, 700.00, 725.00, 750.00, + . 775.00, 800.00, 825.00, 850.00, 875.00, 900.00, 925.00, 950.00, + . 975.00,1000.00,1025.00,1050.00,1075.00,1100.00,1125.00,1150.00, + . 1175.00,1200.00,1225.00,1250.00,1275.00,1300.00,1325.00,1350.00, + . 1375.00,1400.00,1425.00,1450.00,1475.00,1500.00,1525.00,1550.00, + . 1575.00,1600.00,1610.00,1620.00,1630.00,1643.91/ + data bf/ 0.067, 0.088, 0.117, 0.155, 0.206, 0.283, 0.414, + . 0.703, 1.24, 2.33, 11.60, 13.90, 24.30, 66.70, 95.00, + . 56.60, 20.00, 14.60, 8.50, 7.10, 5.43, 5.91, 7.29, + . 7.918, 9.453, 11.08, 12.75, 14.46, 16.19, 17.92, 19.65, + . 21.35, 23.02, 24.65, 26.24, 27.77, 29.23, 30.62, 31.94, + . 33.17, 34.32, 35.37, 36.32, 37.17, 37.91, 38.54, 39.07, + . 39.48, 39.77, 39.95, 40.01, 39.95, 39.77, 39.48, 39.06, + . 38.53, 37.89, 37.13, 36.25, 35.28, 34.19, 33.01, 31.72, + . 30.34, 28.87, 27.33, 25.71, 24.02, 22.26, 20.46, 18.62, + . 16.74, 14.85, 12.95, 11.07, 9.211, 7.407, 5.677, 4.052, + . 2.575, 1.302, 0.8697, 0.4974, 0.1989, 0. / +C Bell and Berrington (1987, J.Phys.B, 20, 801-806) + data wavek/ .50,.40,.35,.30,.25,.20,.18,.16,.14,.12,.10,.09,.08, + . .07,.06,.05,.04,.03,.02,.01,.008,.006/ + data thetaff/ + . 0.5, 0.6, 0.8, 1.0, 1.2, 1.4, 1.6, 1.8, 2.0, 2.8, 3.6/ + data ffbeg/ + ..0178,.0222,.0308,.0402,.0498,.0596,.0695,.0795,.0896, .131, .172, 1823 + ..0228,.0280,.0388,.0499,.0614,.0732,.0851,.0972, .110, .160, .211, 2278 + ..0277,.0342,.0476,.0615,.0760,.0908, .105, .121, .136, .199, .262, 2604 + ..0364,.0447,.0616,.0789,.0966, .114, .132, .150, .169, .243, .318, 3038 + ..0520,.0633,.0859, .108, .131, .154, .178, .201, .225, .321, .418, 3645 + ..0791,.0959, .129, .161, .194, .227, .260, .293, .327, .463, .602, 4557 + ..0965, .117, .157, .195, .234, .272, .311, .351, .390, .549, .711, 5063 + . .121, .146, .195, .241, .288, .334, .381, .428, .475, .667, .861, 5696 + . .154, .188, .249, .309, .367, .424, .482, .539, .597, .830, 1.07, 6510 + . .208, .250, .332, .409, .484, .557, .630, .702, .774, 1.06, 1.36, 7595 + . .293, .354, .468, .576, .677, .777, .874, .969, 1.06, 1.45, 1.83/ 9113 + data ffend/ + . .358, .432, .572, .702, .825, .943, 1.06, 1.17, 1.28, 1.73, 2.17, 10126 + . .448, .539, .711, .871, 1.02, 1.16, 1.29, 1.43, 1.57, 2.09, 2.60, 11392 + . .579, .699, .924, 1.13, 1.33, 1.51, 1.69, 1.86, 2.02, 2.67, 3.31, 13019 + . .781, .940, 1.24, 1.52, 1.78, 2.02, 2.26, 2.48, 2.69, 3.52, 4.31, 15189 + . 1.11, 1.34, 1.77, 2.17, 2.53, 2.87, 3.20, 3.51, 3.80, 4.92, 5.97, 18227 + . 1.73, 2.08, 2.74, 3.37, 3.90, 4.50, 5.01, 5.50, 5.95, 7.59, 9.06, 22784 + . 3.04, 3.65, 4.80, 5.86, 6.86, 7.79, 8.67, 9.50, 10.3, 13.2, 15.6, 30378 + . 6.79, 8.16, 10.7, 13.1, 15.3, 17.4, 19.4, 21.2, 23.0, 29.5, 35.0, 45567 + . 27.0, 32.4, 42.6, 51.9, 60.7, 68.9, 76.8, 84.2, 91.4, 117., 140., 91134 + . 42.3, 50.6, 66.4, 80.8, 94.5, 107., 120., 131., 142., 183., 219., 113918 + . 75.1, 90.0, 118., 144., 168., 191., 212., 234., 253., 325., 388./ 151890 + data (xhmin(i),i=1,100)/100*0.0/ + data modcount,istart/ 0,0/ + +c fill some arrays once and for all + if (istart .eq. 0) then + istart = 1 +c 91.134 number taken from Bell & Berrington + do iwave=1,22 + wfflog(iwave) = dlog(91.134d0/wavek(iwave)) + do itheta=1,11 + fflog(iwave,itheta) = dlog(ff(itheta,iwave)*1.d-26) + enddo + enddo + endif + +c initialize some quantities for each new model atmosphere +c .754209 Hotop & Lineberger (1985, J. Phys. Chem. Ref. Data, 14,731-752) + if (modelnum .ne. modcount) then + modcount = modelnum + do i=1,ntau + xhmin(i) = dexp(.754209/tkev(i))/(2.*2.4148d15*t(i)**1.5)* + . numdens(1,1,i)/u(1,1,i)*ne(i) + enddo + endif + +c main opacity computation yielding "aHminus" + wave = 2.99792458d17/freq + wavelog = dlog(wave) + do itheta=1,11 + nnnn = 22 + call linter (wfflog,fflog(1,itheta),nnnn,wavelog,fftlog,1) + fftt(itheta) = dexp(fftlog)/thetaff(itheta)*5040.*1.380658E-16 + enddo + hminbf = 0. + nnnn = 85 + if (freq .gt. 1.82365d14) + . maxwave = map1(wbf,bf,nnnn,wave,hminbf,1) + do i=1,ntau + nnnn = 11 + call linter (thetaff,fftt,nnnn,theta(i),fftheta(i),1) + hminff = fftheta(i)*numdens(1,1,i)/u(1,1,i)*2.*ne(i) + h = hminbf*1.d-18*(1.-evhkt(i))*xhmin(i) + aHminus(i) = h + hminff + enddo + + return + end + + + + + + subroutine linter (xold,yold,nold,xnew,ynew,nnew) +c****************************************************************************** +c this is a linear interpolation scheme. The arrays "xold" and "xnew" +c should be increasing order. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + real*8 xold(*), yold(*), xnew(*), ynew(*) + + iold = 2 + do inew=1,nnew +1 if (xnew(inew).lt.xold(iold) .or. iold.eq.nold) then + ynew(inew) = yold(iold-1) + (yold(iold)-yold(iold-1))/ + . (xold(iold)-xold(iold-1))*(xnew(inew)-xold(iold-1)) + return + else + iold = iold + 1 + go to 1 + endif + enddo + + end + + + + + + + integer function map1 (xold,fold,nold,xnew,fnew,nnew) +c****************************************************************************** +c This is an interpolation scheme that is copied blindly from ATLAS. +c I decided that it would be too dangerous to re-write this one. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + real*8 xold(*), fold(*), xnew(*), fnew(*) + + l = 2 + ll = 0 + do 50 k=1,nnew +10 if(xnew(k) .lt. xold(l)) go to 20 + l = l + 1 + if (l .gt. nold) go to 30 + go to 10 +20 if (l .eq. ll) go to 50 + if (l .eq. 2) go to 30 + if (l .eq. 3) go to 30 + l1 = l - 1 + if (l.gt.ll+1 .or. l.eq.3) go to 21 + if (l.gt.ll+1 .or. l.eq.4) go to 21 + cbac = cfor + bbac = bfor + abac = afor + if (l .eq. nold) go to 22 + go to 25 +21 l2 = l - 2 + d = (fold(l1)-fold(l2))/(xold(l1)-xold(l2)) + cbac = fold(l)/((xold(l)-xold(l1))*(xold(l)-xold(l2)))+ + . (fold(l2)/(xold(l)-xold(l2))-fold(l1)/(xold(l)-xold(l1)))/ + . (xold(l1)-xold(l2)) + bbac = d - (xold(l1)+xold(l2))*cbac + abac = fold(l2) - xold(l2)*d + xold(l1)*xold(l2)*cbac + if (l .lt. nold) go to 25 +22 c = cbac + b = bbac + a = abac + ll = l + go to 50 +25 d = (fold(l)-fold(l1))/(xold(l)-xold(l1)) + cfor = fold(l+1)/((xold(l+1)-xold(l))*(xold(l+1)-xold(l1)))+ + . (fold(l1)/(xold(l+1)-xold(l1))-fold(l)/(xold(l+1)-xold(l)))/ + . (xold(L)-xold(l1)) + bfor = d - (xold(l)+xold(l1))*cfor + afor = fold(l1) - xold(l1)*d + xold(l)*xold(l1)*cfor + wt = 0. + if (dabs(cfor) .ne. 0.) wt = dabs(cfor)/(dabs(cfor)+dabs(cbac)) + a = afor + wt*(abac-afor) + b = bfor + wt*(bbac-bfor) + c = cfor + wt*(cbac-cfor) + ll = l + go to 50 +30 if (l .eq. ll) go to 50 + l = min0(nold,l) + c = 0. + b = (fold(l)-fold(l-1))/(xold(l)-xold(l-1)) + a = fold(l) - xold(l)*b + ll = l +50 fnew(k)= a + (b + c*xnew(k))*xnew(k) + + map1 = ll - 1 + return + end + + + + diff --git a/Opaccouls.f b/Opaccouls.f new file mode 100755 index 0000000..3c4f59d --- /dev/null +++ b/Opaccouls.f @@ -0,0 +1,121 @@ + +c****************************************************************************** +c This file contains the functions coulx, coulbf1s, and coulff; these +c routines are used by the continuous opacity routines. +c****************************************************************************** + + + + real*8 function coulx (n,freq,z) +c****************************************************************************** +c This is function COULX from ATLAS. +c******************************************************************************` + + implicit real*8 (a-h,o-z) + real*8 a(6), b(6), c(6) + data a/ 0.9916, 1.105, 1.101, 1.101, 1.102, 1.0986/ + data b/ 2.719d13, -2.375d14, -9.863d13, -5.765d13, -3.909d13, + . -2.704d13/ + data c/ -2.268d30, 4.077d28, 1.035d28, 4.593d27, 2.371d27, + . 1.229d27/ + + if (freq .lt. z*z*3.28805d15/dfloat(n*n)) then + coulx = 0. + else + coulx = 2.815d29/freq**3/dfloat(n**5)*z**4 + if (n .gt. 6) return + if (n .eq. 1) then + coulx = coulx*coulbf1s(freq,z) + else + coulx = coulx*(a(n)+(b(n)+c(n)*(z*z/freq))*(z*z/freq)) + endif + endif + + return + end + + + + + + real*8 function coulbf1s (freq,z) +c****************************************************************************** +c This is function COULBF1S from ATLAS. +c******************************************************************************` + + implicit real*8 (a-h,o-z) + real*8 gaunt1s(151) + data gaunt1s/ + . 0.7973,0.8094,0.8212,0.8328,0.8439,0.8548,0.8653,0.8754,0.8852, + . 0.8946,0.9035,0.9120,0.9201,0.9278,0.9351,0.9420,0.9484,0.9544, + . 0.9601,0.9653,0.9702,0.9745,0.9785,0.9820,0.9852,0.9879,0.9903, + . 0.9922,0.9938,0.9949,0.9957,0.9960,0.9960,0.9957,0.9949,0.9938, + . 0.9923,0.9905,0.9884,0.9859,0.9832,0.9801,0.9767,0.9730,0.9688, + . 0.9645,0.9598,0.9550,0.9499,0.9445,0.9389,0.9330,0.9269,0.9206, + . 0.9140,0.9071,0.9001,0.8930,0.8856,0.8781,0.8705,0.8627,0.8546, + . 0.8464,0.8381,0.8298,0.8213,0.8128,0.8042,0.7954,0.7866,0.7777, + . 0.7685,0.7593,0.7502,0.7410,0.7318,0.7226,0.7134,0.7042,0.6951, + . 0.6859,0.6767,0.6675,0.6584,0.6492,0.6401,0.6310,0.6219,0.6129, + . 0.6039,0.5948,0.5859,0.5769,0.5680,0.5590,0.5502,0.5413,0.5324, + . 0.5236,0.5148,0.5063,0.4979,0.4896,0.4814,0.4733,0.4652,0.4572, + . 0.4493,0.4415,0.4337,0.4261,0.4185,0.4110,0.4035,0.3962,0.3889, + . 0.3818,0.3749,0.3680,0.3611,0.3544,0.3478,0.3413,0.3348,0.3285, + . 0.3222,0.3160,0.3099,0.3039,0.2980,0.2923,0.2866,0.2810,0.2755, + . 0.2701,0.2648,0.2595,0.2544,0.2493,0.2443,0.2394,0.2345,0.2298, + . 0.2251,0.2205,0.2160,0.2115,0.2072,0.2029,0.1987/ + + if (freq/z**2 .lt. 3.28805d15) then + coulbf1s = 0. + else + elog = log10(freq/z**2/3.28805d15) + i = elog/0.02 + i = max(min(i+1,150),1) + coulbf1s = gaunt1s(i) + + . (gaunt1s(i+1)-gaunt1s(i))/0.02*(elog-(i-1)*0.02) + endif + + return + end + + + + + + + real*8 function coulff (nz,tlog,freq) +c****************************************************************************** +c This is function COULFF from ATLAS. +c******************************************************************************` + + implicit real*8 (a-h,o-z) + real*8 z4log(6), a(11,12) + data z4log/ 0., 1.20412, 1.90849, 2.40824, 2.79588, 3.11261/ + data a/ + . 5.53,5.49,5.46,5.43,5.40,5.25,5.00,4.69,4.48,4.16,3.85, + . 4.91,4.87,4.84,4.80,4.77,4.63,4.40,4.13,3.87,3.52,3.27, + . 4.29,4.25,4.22,4.18,4.15,4.02,3.80,3.57,3.27,2.98,2.70, + . 3.64,3.61,3.59,3.56,3.54,3.41,3.22,2.97,2.70,2.45,2.20, + . 3.00,2.98,2.97,2.95,2.94,2.81,2.65,2.44,2.21,2.01,1.81, + . 2.41,2.41,2.41,2.41,2.41,2.32,2.19,2.02,1.84,1.67,1.50, + . 1.87,1.89,1.91,1.93,1.95,1.90,1.80,1.68,1.52,1.41,1.30, + . 1.33,1.39,1.44,1.49,1.55,1.56,1.51,1.42,1.33,1.25,1.17, + . 0.90,0.95,1.00,1.08,1.17,1.30,1.32,1.30,1.20,1.15,1.11, + . 0.55,0.58,0.62,0.70,0.85,1.01,1.15,1.18,1.15,1.11,1.08, + . 0.33,0.36,0.39,0.46,0.59,0.76,0.97,1.09,1.13,1.10,1.08, + . 0.19,0.21,0.24,0.28,0.38,0.53,0.76,0.96,1.08,1.09,1.09/ + + gamlog = 10.39638 - tlog/1.15129 + z4log(nz) + igam = max0(min0(int(gamlog+7.),10),1) + hvktlg = (dlog(freq) - tlog)/1.15129 - 20.63764 + ihvkt = max0(min0(int(hvktlg+9.),11),1) + p = gamlog - dfloat(igam-7) + q = hvktlg - dfloat(ihvkt-9) + coulff = (1.-p)*((1.-q)*a(igam,ihvkt) + q*a(igam,ihvkt+1)) + + . p*((1.-q)*a(igam+1,ihvkt) + q*a(igam+1,ihvkt+1)) + + return + end + + + + diff --git a/Opacit.f b/Opacit.f new file mode 100755 index 0000000..97ee3c9 --- /dev/null +++ b/Opacit.f @@ -0,0 +1,154 @@ + + subroutine opacit (modeop,waveop) +c****************************************************************************** +c This routine calculates the continuous opacity *kaplam* or +c *kapref* and optical depth *taulam* as needed. the formulas are +c ones lifted from the write-up of program *atlas* +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + include 'Dummy.com' + real*8 taucheck(100), tauinteg(100) + + +c*****initialization + freq = 2.997925d18/waveop + freqlg = dlog(freq) + do i = 1,ntau + hkt = 6.6256d-27/(1.38065d-16*t(i)) + evhkt(i) = dexp(-freq*hkt) + enddo + do i=1,ntau + aH1(i) = 1.d-99 + aHminus(i) = 1.d-99 + aHeminus(i) = 1.d-99 + aC1(i) = 1.d-99 + aMg1(i) = 1.d-99 + aMg2(i) = 1.d-99 + aAl1(i) = 1.d-99 + aSi1(i) = 1.d-99 + aSi2(i) = 1.d-99 + aFe1(i) = 1.d-99 + enddo + + +c*****compute the opacities + call opacH1 + call opacHminus + call opacHscat + call opacH2scat + call opacHeminus + call opacHescat + call opacescat + call opacC1 + call opacMg1 + call opacMg2 + call opacAl1 + call opacSi1 + call opacSi2 + call opacFe1 + + +c*****sum up all the opacities + do i=1,ntau + kaplamabs(i) = aH1(i) + aHminus(i) + aHeminus(i) + aC1(i) + + . aMg1(i) + aMg2(i) + aAl1(i) + aSi1(i) + + . aSi2(i) + aFe1(i) + kaplamsca(i) = sigH(i) + sigH2(i) + sigHe(i) + sigel(i) + kaplam(i) = kaplamabs(i) + kaplamsca(i) + enddo + + +c*****write out the opacities + if (modprintopt .gt. 1) then + write (nf1out,1001) waveop + do i=1,ntau + write (nf1out,1002) i, nint(t(i)), dlog10(kaplam(i)), + . dlog10(aH1(i)), dlog10(aHminus(i)), dlog10(sigH(i)), + . dlog10(aHeminus(i)), dlog10(sigHe(i)), dlog10(sigel(i)), + . dlog10(sigH2(i)) + enddo + write (nf1out,1003) waveop + do i=1,ntau + write (nf1out,1002) i, nint(t(i)), dlog10(kaplam(i)), + . dlog10(aC1(i)), dlog10(aMg1(i)), dlog10(aMg2(i)), + . dlog10(aAl1(i)), dlog10(aSi1(i)), dlog10(aSi2(i)), + . dlog10(aFe1(i)) + enddo + endif + + +c*****add in an arbitrary amount of "extra" continuous opacity; +c this is a pure fudge factor, so experiment with care + if (fudge .gt. 0.0) then + do i=1,ntau + kaplam(i) = kaplam(i)*((fudge*10000)/t(i)) + if (i .eq. 1) then + write(nf1out,1005) + write(nf1out,1006) fudge + endif + enddo + endif + + +c*****compute an optical depth array at this wavelength, and exit + if (modeop .ne. 1) then + do i=1,ntau + dummy1(i) = tauref(i)*kaplam(i)/(0.4343*kapref(i)) + enddo + first = tauref(1)*kaplam(1)/kapref(1) + dummy1(1) = rinteg(xref,dummy1,taulam,ntau,first) + taulam(1) = first + do i=2,ntau + taulam(i) = taulam(i-1) + taulam(i) + enddo + if (modprintopt .gt. 1) write(nf1out,1004) (taulam(i),i=1,ntau) + return + endif + + +c*****here is the assignment of opacities kaplam to kapref; exit normally + do i=1,ntau + kapref(i) = kaplam(i) + enddo + if(modprintopt .lt. 2) return + + +c*****here is an internal tauref check on the externally read in tau scale; +c then exit normally + do i=1,ntau + dummy1(i) = dlog10(tauref(i)) + tauinteg(i) = tauref(i)*kaplam(i)/(0.4343*kapref(i)) + enddo + first = tauref(1) + tauinteg(1) = rinteg(dummy1,tauinteg,taucheck,ntau,first) + taucheck(1) = first + do i=2,ntau + taucheck(i) = taucheck(i-1) + taucheck(i) + enddo + write (nf1out,1004) (taucheck(i),i=1,ntau) + return + + +c*****format statements +1001 format (/'log opacities due to H, He, e- at a wavelength of ', + . f10.2,' A'/' i T(i) kaplam aH1 aH- sigH', + . ' aHe- sigHe sigel sigH2') +1002 format (i2,i6,10f8.2) +1003 format (/'log opacities due to "metal" edges at a wavelength', + . ' of ',f10.2,' A'/' i T(i) kaplam aC1 aMg1', + . ' aMg2 aAl1 aSi1 aSi2 aFe1') +1004 format(/'COMPUTED TAULAM ARRAY'/(1p7e11.3)) +1005 format ('Opacities artificially are now ', + . 'altered by scaling law of: ') +1006 format (' kaplam(i) = kaplam(i) * ', + . '((', f6.2, ' * 10000)/t(i))') + + + end + + + + diff --git a/Opacmetals.f b/Opacmetals.f new file mode 100755 index 0000000..41a24e1 --- /dev/null +++ b/Opacmetals.f @@ -0,0 +1,504 @@ + +c****************************************************************************** +c The subroutines needed to calculate the Mg I, Mg II, Al I, Si I, Si II, +c and Fe I b-f opacities are in this file. These are from ATLAS9. +c****************************************************************************** + + + + + + subroutine opacC1 +c****************************************************************************** +c This routine computes the bound-free absorption due to C I. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + real*8 c1240(100), c1444(100) + save + data freq1, modcount/0. ,0/ + +c initialize some quantities for each new model atmosphere + if (modelnum .ne. modcount) then + modcount = modelnum + do i=1,ntau + c1240(i) = 5.*dexp(-1.264/tkev(i)) + c1444(i) = dexp(-2.683/tkev(i)) + enddo + endif + +c initialize some quantities for each new model atmosphere or new frequency; +c Luo, D. and Pradhan, A.K. 1989, J.Phys. B, 22, 3377-3395. +c Burke, P.G. and Taylor, K.T. 1979, J. Phys. B, 12, 2971-2984. + if (modelnum.ne.modcount .or. freq.ne.freq1) then + freq1 = freq + ryd = 109732.298 + waveno = freq/2.99792458d10 + xs0 = 0. + xs1 = 0. + xd0 = 0. + xd1 = 0. + xd2 = 0. + x1444 = 0. + x1240 = 0. + x1100 = 0. +c P2 3P 1 +c I AM NOT SURE WHETHER THE CALL TO SEATON IN THE NEXT STATEMENT IS +c CORRECT, BUT IT ONLY AFFECTS THINGS BELOW 1100A + if (freq .ge. 2.7254d15) x1100 = + . 10.**(-16.80-(waveno-90777.000)/3./ryd)* + . seaton (2.7254d15,1.219d-17,2.d0,3.317d0) +c P2 1D 2 + if (freq .ge. 2.4196d15) then + xd0 = 10.**(-16.80-(waveno-80627.760)/3./ryd) + eeps = (waveno-93917.)*2./9230. + aa = 22.d-18 + bb = 26.d-18 + xd1 = (aa*eeps+bb)/(eeps**2+1.) + eeps = (waveno-111130.)*2./2743. + aa = -10.5d-18 + bb = 46.d-18 + xd2 = (aa*eeps+bb)/(eeps**2+1.) + x1240 = xd0 + xd1 + xd2 + endif +c P2 1S 3 + if (freq .ge. 2.0761d15) then + xs0 = 10.**(-16.80-(waveno-69172.400)/3./ryd) + eeps = (waveno-97700.)*2./2743. + aa = 68.d-18 + bb = 118.d-18 + xs1 = (aa*eeps+bb)/(eeps**2+1.) + x1444 = xs0 + xs1 + endif + endif + + do i=1,ntau + if (freq .ge. 2.0761d15) then + aC1(i) = (x1100*9. + x1240*c1240(i) + x1444*c1444(i))* + . numdens(3,1,i)/u(6,1,i) + endif + enddo + + return + end + + + + + + + + + subroutine opacMg1 +c****************************************************************************** +c This routine computes the bound-free absorption due to Mg I. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + real*8 flog(9), freqMg(7), peach(7,15), xx(7), tlg(7) + real*8 dt(100) + integer nt(100) + save + data peach/ +c 4000 5000 6000 7000 8000 9000 10000 + . -42.474, -42.350, -42.109, -41.795, -41.467, -41.159, -40.883, + . -41.808, -41.735, -41.582, -41.363, -41.115, -40.866, -40.631, + . -41.273, -41.223, -41.114, -40.951, -40.755, -40.549, -40.347, + . -45.583, -44.008, -42.957, -42.205, -41.639, -41.198, -40.841, + . -44.324, -42.747, -41.694, -40.939, -40.370, -39.925, -39.566, + . -50.969, -48.388, -46.630, -45.344, -44.355, -43.568, -42.924, + . -50.633, -48.026, -46.220, -44.859, -43.803, -42.957, -42.264, + . -53.028, -49.643, -47.367, -45.729, -44.491, -43.520, -42.736, + . -51.785, -48.352, -46.050, -44.393, -43.140, -42.157, -41.363, + . -52.285, -48.797, -46.453, -44.765, -43.486, -42.480, -41.668, + . -52.028, -48.540, -46.196, -44.507, -43.227, -42.222, -41.408, + . -52.384, -48.876, -46.513, -44.806, -43.509, -42.488, -41.660, + . -52.363, -48.856, -46.493, -44.786, -43.489, -42.467, -41.639, + . -54.704, -50.772, -48.107, -46.176, -44.707, -43.549, -42.611, + . -54.359, -50.349, -47.643, -45.685, -44.198, -43.027, -42.418/ + data freqMg/ 1.9341452d15, 1.8488510d15, 1.1925797d15, + . 7.9804046d14, 4.5772110d14, 4.1440977d14, + . 4.1113514d14/ + data flog/ 35.23123, 35.19844, 35.15334, 34.71490, 34.31318, + . 33.75728, 33.65788, 33.64994, 33.43947/ + data tlg/ 8.29405, 8.51719, 8.69951, 8.85367, 8.98720, 9.10498, + . 9.21034/ + data freq1, modcount/0. ,0/ + +c initialize some quantities for each new model atmosphere + if (modelnum .ne. modcount) then + modcount = modelnum + do i=1,ntau + n = max0(min0(6,nint(t(i)/1000.)-3),1) + nt(i) = n + dt(i) = (tlog(i)-tlg(n))/(tlg(n+1)-tlg(n)) + enddo + endif + +c initialize some quantities for each new model atmosphere or new frequency; + if (modelnum.ne.modcount .or. freq.ne.freq1) then + freq1 = freq + do n=1,7 + if (freq .gt. freqMg(n)) go to 23 + enddo + n = 8 +23 dd = (freqlg-flog(n))/(flog(n+1)-flog(n)) + if (n .gt. 2) n = 2*n -2 + dd1 = 1.0 - dd + do it=1,7 + xx(it) = peach(it,n+1)*dd + peach(it,n)*dd1 + enddo + endif + + do i=1,ntau + if (freq .ge. 2.997925d+14) then + n = nt(i) + aMg1(i) = dexp(xx(n)*(1.d0-dt(i))+xx(n+1)*dt(i))* + . numdens(4,1,i)/u(12,1,i) + endif + enddo + + return + end + + + + + + + + subroutine opacMg2 +c****************************************************************************** +c This routine computes the bound-free absorption due to Mg II. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + real*8 c1169(100) + save + data freq1, modcount/0. ,0/ + +c initialize some quantities for each new model atmosphere + if (modelnum .ne. modcount) then + modcount = modelnum + do i=1,ntau + c1169(i) = 6.*dexp(-4.43d+0/tkev(i)) + enddo + endif + +c initialize some quantities for each new model atmosphere or new frequency; +c there are two edges, one at 824 A and the other at 1169 A + if (modelnum.ne.modcount .or. freq.ne.freq1) then + freq1 = freq + if (freq .ge. 3.635492d15) then + x824 = seaton (3.635492d15,1.40d-19,4.d0,6.7d0) + else + x824 = 1.d-99 + endif + if (freq .ge. 2.564306d15) then + x1169 = 5.11d-19*(2.564306d15/freq)**3 + else + x1169 = 1.d-99 + endif + endif + + do i=1,ntau + if (x1169 .ge. 1.d-90) then + aMg2(i) = (x824*2. + x1169*c1169(i))* + . numdens(4,2,i)/u(12,2,i) + endif + enddo + + return + end + + + + + + + + + subroutine opacAl1 +c****************************************************************************** +c This routine computes the bound-free absorption due to Al I. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + + do i=1,ntau + if (freq .ge. 1.443d15) then + aAl1(i) = 6.5d-17*(1.443d15/freq)**5*6.* + . numdens(5,1,i)/u(13,1,i) + endif + enddo + + return + end + + + + + + + + + + subroutine opacSi1 +c****************************************************************************** +c This routine computes the bound-free absorption due to Si I. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + real*8 flog(11), freqSi(9), xx(9), tlg(9), dt(100) + integer nt(100) + real*8 peach(9,19) + save + data peach/ +c 4000 5000 6000 7000 8000 9000 10000 11000 12000 + . 38.136,38.138,38.140,38.141,38.143,38.144,38.144,38.145,38.145, + . 37.834,37.839,37.843,37.847,37.850,37.853,37.855,37.857,37.858, + . 37.898,37.898,37.897,37.897,37.897,37.896,37.895,37.895,37.894, + . 40.737,40.319,40.047,39.855,39.714,39.604,39.517,39.445,39.385, + . 40.581,40.164,39.893,39.702,39.561,39.452,39.366,39.295,39.235, + . 45.521,44.456,43.753,43.254,42.878,42.580,42.332,42.119,41.930, + . 45.520,44.455,43.752,43.251,42.871,42.569,42.315,42.094,41.896, + . 55.068,51.783,49.553,47.942,46.723,45.768,44.997,44.360,43.823, + . 53.868,50.369,48.031,46.355,45.092,44.104,43.308,42.652,42.100, + . 54.133,50.597,48.233,46.539,45.261,44.262,43.456,42.790,42.230, + . 54.051,50.514,48.150,46.454,45.176,44.175,43.368,42.702,42.141, + . 54.442,50.854,48.455,46.733,45.433,44.415,43.592,42.912,42.340, + . 54.320,50.722,48.313,46.583,45.277,44.251,43.423,42.738,42.160, + . 55.691,51.965,49.444,47.615,46.221,45.119,44.223,43.478,42.848, + . 55.661,51.933,49.412,47.582,46.188,45.085,44.189,43.445,42.813, + . 55.973,52.193,49.630,47.769,46.349,45.226,44.314,43.555,42.913, + . 55.922,52.141,49.577,47.715,46.295,45.172,44.259,43.500,42.858, + . 56.828,52.821,50.110,48.146,46.654,45.477,44.522,43.730,43.061, + . 56.657,52.653,49.944,47.983,46.491,45.315,44.360,43.569,42.901/ +c 3P, 1D, 1S, 1D, 3D, 3F, 1D, 3P + data freqSi/ 2.1413750d15, 1.9723165d15, 1.7879689d15, + . 1.5152920d15, 5.5723927d14, 5.3295914d14, + . 4.7886458d14, 4.7216422d14, 4.6185133d14/ + data flog/ 35.45438, 35.30022, 35.21799, 35.11986, 34.95438, + . 33.95402, 33.90947, 33.80244, 33.78835, 33.76626, + . 33.70518/ + data tlg/ 8.29405, 8.51719, 8.69951, 8.85367, 8.98720, 9.10498, + . 9.21034, 9.30565, 9.39266/ + data freq1, modcount/0. ,0/ + +c initialize some quantities for each new model atmosphere + if (modelnum .ne. modcount) then + modcount = modelnum + do i=1,ntau + n = max0(min0(8,nint(t(i)/1000.)-3),1) + nt(i) = n + dt(i) = (tlog(i)-tlg(n))/(tlg(n+1)-tlg(n)) + enddo + endif + +c initialize some quantities for each new model atmosphere or new frequency + if (modelnum.ne.modcount .or. freq.ne.freq1) then + freq1 = freq + do n=1,9 + if (freq .gt. freqSi(n)) go to 23 + enddo + n = 10 +23 dd = (freqlg-flog(n))/(flog(n+1)-flog(n)) + if (n .gt. 2) n = 2*n - 2 + dd1 = 1.0 - dd + do it=1,9 + xx(it) = peach(it,n+1)*dd + peach(it,n)*dd1 + enddo + endif + + do i=1,ntau + if (freq .ge. 2.997925d+14) then + n = nt(i) + aSi1(i) = (dexp(-(xx(n)*(1.-dt(i)) + xx(n+1)*dt(i)))*9.)* + . numdens(6,1,i)/u(14,1,i) + endif + enddo + + return + end + + + + + + + subroutine opacSi2 +c****************************************************************************** +c This routine computes the bound-free absorption due to Si II. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + real*8 flog(9), freqSi(7), peach(6,14), xx(6), tlg(6), dt(100) + integer nt(100) + save + data peach/ +c 10000 12000 14000 16000 18000 20000 + . -43.8941, -43.8941, -43.8941, -43.8941, -43.8941, -43.8941, + . -42.2444, -42.2444, -42.2444, -42.2444, -42.2444, -42.2444, + . -40.6054, -40.6054, -40.6054, -40.6054, -40.6054, -40.6054, + . -54.2389, -52.2906, -50.8799, -49.8033, -48.9485, -48.2490, + . -50.4108, -48.4892, -47.1090, -46.0672, -45.2510, -44.5933, + . -52.0936, -50.0741, -48.5999, -47.4676, -46.5649, -45.8246, + . -51.9548, -49.9371, -48.4647, -47.3340, -46.4333, -45.6947, + . -54.2407, -51.7319, -49.9178, -48.5395, -47.4529, -46.5709, + . -52.7355, -50.2218, -48.4059, -47.0267, -45.9402, -45.0592, + . -53.5387, -50.9189, -49.0200, -47.5750, -46.4341, -45.5082, + . -53.2417, -50.6234, -48.7252, -47.2810, -46.1410, -45.2153, + . -53.5097, -50.8535, -48.9263, -47.4586, -46.2994, -45.3581, + . -54.0561, -51.2365, -49.1980, -47.6497, -46.4302, -45.4414, + . -53.8469, -51.0256, -48.9860, -47.4368, -46.2162, -45.2266/ + data freqSi/ 4.9965417d15, 3.9466738d15, 1.5736321d15, + . 1.5171539d15, 9.2378947d14, 8.3825004d14, + . 7.6869872d14/ +c 2P, 2D, 2P, 2D, 2P + data flog/ 36.32984, 36.14752, 35.91165, 34.99216, 34.95561, + . 34.45951, 34.36234, 34.27572, 34.20161/ + data tlg/ 9.21034, 9.39266, 9.54681, 9.68034, 9.79813, 9.90349/ + data freq1, modcount/0., 0/ + +c set up some data upon first entrance with a new model atmosphere + if (modelnum .ne. modcount) then + modcount = modelnum + do i=1,ntau + n = max0(min0(5,nint(t(i)/2000.)-4),1) + nt(i) = n + dt(i) = (tlog(i)-tlg(n))/(tlg(n+1)-tlg(n)) + enddo + endif + +c initialize some quantities for each new model atmosphere or new frequency + if (modelnum.ne.modcount .or. freq.ne.freq1) then + freq1 = freq + do n=1,7 + if (freq .gt. freqSi(n)) go to 23 + enddo + n = 8 +23 dd = (freqlg-flog(n))/(flog(n+1)-flog(n)) + if (n .gt. 2) n = 2*n - 2 + if (n .eq. 14) n = 13 + dd1 = 1.0 - dd + do it=1,6 + xx(it) = peach(it,n+1)*dd + peach(it,n)*dd1 + enddo + endif + + do i=1,ntau + if (freq .ge. 7.6869872d14) then + n = nt(i) + aSi2(i) = (dexp(xx(n)*(1.-dt(i)) + xx(n+1)*dt(i))*6.)* + . numdens(6,2,i)/u(14,2,i) + endif + enddo + + return + end + + + + + + + + subroutine opacFe1 +c****************************************************************************** +c This routine computes the bound-free absorption due to Fe I. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + real*8 bolt(48,100), gg(48), ee(48), wno(48), xsect(48) + save + data gg/25.,35.,21.,15.,9.,35.,33.,21.,27.,49.,9.,21.,27.,9.,9., + . 25.,33.,15.,35.,3.,5.,11.,15.,13.,15.,9.,21.,15.,21.,25.,35., + . 9.,5.,45.,27.,21.,15.,21.,15.,25.,21.,35.,5.,15.,45.,35.,55.,25./ + data ee/500.,7500.,12500.,17500.,19000.,19500.,19500.,21000., + . 22000.,23000.,23000.,24000.,24000.,24500.,24500.,26000.,26500., + . 26500.,27000.,27500.,28500.,29000.,29500.,29500.,29500.,30000., + . 31500.,31500.,33500.,33500.,34000.,34500.,34500.,35000.,35500., + . 37000.,37000.,37000.,38500.,40000.,40000.,41000.,41000.,43000., + . 43000.,43000.,43000.,44000./ + data wno/63500.,58500.,53500.,59500.,45000.,44500.,44500.,43000., + . 58000.,41000.,54000.,40000.,40000.,57500.,55500.,38000.,57500., + . 57500.,37000.,54500.,53500.,55000.,34500.,34500.,34500.,34000., + . 32500.,32500.,32500.,32500.,32000.,29500.,29500.,31000.,30500., + . 29000.,27000.,54000.,27500.,24000.,47000.,23000.,44000.,42000., + . 42000.,21000.,42000.,42000./ + data freq1, modcount/0., 0/ + +c set up some data upon first entrance with a new model atmosphere + if (modelnum .ne. modcount) then + modcount = modelnum + do i=1,ntau + hkt = 6.6256d-27/(1.38065d-16*t(i)) + do k=1,48 + bolt(k,i) = gg(k)*dexp(-ee(k)*2.99792458d10*hkt) + enddo + enddo + endif + +c initialize some quantities for each new model atmosphere or new frequency; +c the absorption begins at 4762 A. + if (modelnum.ne.modcount .or. freq.ne.freq1) then + freq1 = freq + waveno = freq/2.99792458d10 + if (waveno .ge. 21000.) then + do k=1,48 + xsect(k) = 0. + if (wno(k) .lt. waveno) xsect(k)= 3.d-18/ + . (1.+((wno(k)+3000.-waveno)/wno(k)/.1)**4) + enddo + endif + endif + + do i=1,ntau + if (waveno .ge. 21000.) then + do k=1,48 + aFe1(i) = aFe1(i) + xsect(k)*bolt(k,i)* + . numdens(7,1,i)/u(26,1,i) + enddo + endif + + enddo + + return + end + + + + + + + + real*8 function seaton (freq0,xsect,power,a) +c****************************************************************************** +c This function is a general representation for b-f absorption above +c a given ionization limit freq0, using cross-section xsect, +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Kappa.com' + freqratio = freq0/freq + seaton = xsect*(a + freqratio*(1.0-a))* + . dsqrt(freqratio**(nint(2.*power+0.01))) + + return + end + + diff --git a/Opacscat.f b/Opacscat.f new file mode 100755 index 0000000..b057723 --- /dev/null +++ b/Opacscat.f @@ -0,0 +1,104 @@ + +c****************************************************************************** +c The subroutines needed to calculate the opacities from scattering by +c H I, H2, He I, and e- are in this file. These are from ATLAS9. +c****************************************************************************** + + + + + + + subroutine opacescat +c****************************************************************************** +c This routine computes electron scattering opacities. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + save + data modcount/0/ + +c compute scattering, but only if there is a new model atmosphere. + if (modelnum .ne. modcount) then + modcount = modelnum + do i=1,ntau + sigel(i) = 0.6653d-24*ne(i) + enddo + endif + + return + end + + + subroutine opacHscat +c****************************************************************************** +c This routine computes H I Rayleigh scattering opacities. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + include 'Linex.com' + + wavetemp = 2.997925d18/dmin1(freq,2.463d15) + ww = wavetemp**2 + sig = (5.799d-13+1.422d-6/ww+2.784/(ww*ww))/(ww*ww) + do i=1,ntau + sigH(i) = sig*2.*numdens(1,1,i)/u(1,1,i) + enddo + + return + end + + + subroutine opacH2scat +c****************************************************************************** +c This routine computes H2 I Rayleigh scattering opacities. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + include 'Linex.com' + + wavetemp = 2.997925d18/dmin1(freq,2.463d15) + ww = wavetemp**2 + sig = (8.14d-13+1.28d-6/ww+1.61/(ww*ww))/(ww*ww) + do i=1,ntau + sigH2(i) = sig*numdens(8,1,i) + enddo + + return + end + + + subroutine opacHescat +c****************************************************************************** +c This routine computes He I Rayleigh scattering opacities. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Kappa.com' + include 'Linex.com' + + wavetemp = 2.997925d18/dmin1(freq,5.15d15) + ww = wavetemp**2 + sig = 5.484E-14/ww/ww*(1.+(2.44d5+5.94d10/(ww-2.90d5))/ww)**2 + do i=1,ntau + sigHe(i) = sig*numdens(2,1,i)/u(2,1,i) + enddo + + return + end + + + + + + + + + diff --git a/Params.f b/Params.f new file mode 100755 index 0000000..a9be3d2 --- /dev/null +++ b/Params.f @@ -0,0 +1,813 @@ + + subroutine params +c****************************************************************************** +c This subroutine reads in the commands from the parameter file +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Factor.com' + include 'Pstuff.com' + include 'Obspars.com' + include 'Mol.com' + include 'Multistar.com' + real*8 deltalogab(5) + character keyword*20 + character arrayz*80 + integer kk + data newcount, linecount /0, 0/ + + + if (linecount .eq. 0) oldcount = 0 + + +c IF DOING MULTIPLE RUNS: if this is not the first reading of the +c parameter file, then read down to correct place in parameter file, +c using "linecount", and then skip the re-initialization of the +c various variables + rewind nfparam + read (nfparam,1001,end=100) arrayz + if (linecount .ne. 0) then + do i=1,linecount + read (nfparam,1001,end=100) arrayz + enddo + go to 4 + endif + + +c INITIALIZE SOME VARIABLES: output file names and output file numbers +c f1out, nf1out: verbose standard output +c f2out, nf2out: raw synthetic spectra, or summary abundances, or +c summary curves-of-growth +c f3out, nf3out: smoothed synthetic spectra +c f4out, nf4out: IRAF-text-style synthetic spectra output +c f5out, nf5out: postscript plot output +c f6out, nf6out: synthetic/observed comparison text output (gridsyn) +c f7out, nf7out: raw synthetic spectrum of primary of a binary, +c output summary run table, or +c to be used for some other purpose as needed; at +c present not given keyword input +c f8out, nf8out: raw synthetic spectrum of secondary of a binary, +c or the kept lines in a line weedout, or for +c some other purpose as needed +c f9out, nf9out: combined smoothed synthetic spectrum of a binary star, +c or the discarded lines in a line weedout, or the +c mean raw synthesis for a population of stars, or +c some other purpose as needed +c to be used for some other purpose as needed` +c f10out, nf10out: combined smoothed synthetic spectrum of a binary star, +c to be used for some other purpose as needed` + f1out = 'no_filename_given' + f2out = 'no_filename_given' + f3out = 'no_filename_given' + f4out = 'no_filename_given' + f5out = 'optional_output_file' + f6out = 'optional_output_file' + f7out = 'no_filename_given' + f8out = 'no_filename_given' + f9out = 'no_filename_given' + f10out = 'no_filename_given' + nf1out = 0 + nf2out = 0 + nf3out = 0 + nf4out = 0 + nf5out = 0 + nf6out = 0 + nf7out = 0 + nf8out = 0 + nf9out = 0 + nf10out = 0 + modelnum = 0 + + +c INITIALIZE SOME VARIABLES: input file names and input file numbers + fmodel = 'no_filename_given' + flines = 'no_filename_given' + fslines = 'no_filename_given' + fobs = 'no_filename_given' + ftable = 'no_filename_given' + nfmodel = 0 + nflines = 0 + nfslines = 0 + nfobs = 0 + nftable = 0 + + +c INITIALIZE SOME VARIABLES: terminal type; +c set smterm = ' ' for the plotting package 'sm' + smterm = 'x11' + + +c INITIALIZE SOME VARIABLES: +c atmosphere data printing: modprintopt [old ipr(1)] +c molecular equilibrium: molopt [old ipr(2)] +c line data: linprintopt [old ipr(3)] +c flux/intensity fluxintopt [old ipr(4)] +c synthesis/single line computations: [deleted] [old ipr(5)] +c line formation level [deleted] [old ipr(6)] +c plotting: plotopt [old ipr(7)] +c damping dampingopt [old ipr(8)] +c observed spectrum file type specfileopt [old ipr(9)] +c format of linelist (formatted/not) linfileopt +c source function with scat+abs scatopt + modprintopt = 1 + molopt = 1 + linprintopt = 1 + fluxintopt = 0 + plotopt = 0 + dampingopt = 0 + specfileopt = 0 + linfileopt = 0 + iunits = 0 + itru = 0 + iscale = 0 + nlines = 0 + iraf = 0 + histoyes = 0 + byteswap = 0 + deviations = 0 + scatopt = 0 + gfstyle = 0 + maxshift = 0 + dostrong = 0 + molset = 0 + + +c INITIALIZE SOME VARIABLES: +c if fudge is less than or equal to 0 then it does not scale it...make it +c -1.0 just to be sure we dont have floating point problems with 0.0 + fudge = -1.0 + + +c INITIALIZE SOME VARIABLES: spectrum run parameters + oldstart = 0. + start = 0. + sstop = 0. + step = 0. + delta = 0. + cogatom = 0. + contnorm = 1.0 + + +c INITIALIZE SOME VARIABLES: line limit parameters + ncurve = 0 + lim1line = 0 + lim2line = 0 + lim1obs = 0 + lim2obs = 0 + lim1 = 0 + lim2 = 0 + + +c INITIALIZE SOME VARIABLES: spectroscopic binary parameters + deltaradvel = 0. + lumratio = 1. + + +c INITIALIZE SOME VARIABLES: elements with special abundance data; for +c practical reasons, keyword "abundances" and "isotopes" must be specified +c in each RUN; they must be reset each time. +4 neq = 0 + numpecatom = 0 + numatomsyn = 0 + newnumpecatom = 0 + newnumatomsyn = 0 + ninetynineflag = 0 + do i=1,95 + pec(i) = 0 + newpec(i) = 0 + do j=1,5 + abfactor(j) = 0. + pecabund(i,j) = 0. + newpecabund(i,j) = 0. + enddo + enddo + numiso = 0 + numisosyn = 0 + newnumiso = 0 + newnumisosyn = 0 + do i=1,20 + isotope(i) = 0. + newisotope(i) = 0. + do j=1,5 + isoabund(i,j) = 0. + newisoabund(i,j) = 0. + enddo + enddo + + +c read a line of the parameter file into "arrayz"; decode it to get the +c key word, which is always within the first 20 characters; dump the +c rest of arrayz into "array" +5 write (array,1007) + read (nfparam,1001,end=98) arrayz + linecount = linecount + 1 + i=index(arrayz,' ') + keyword = arrayz(1:i-1) + array = arrayz(i:) + + +c keyword 'RUN' signals that there are either multiple syntheses being +c done or multiple comparisons with observed spectra + if (keyword .eq. 'RUN') then + read (array,*) newcount + if (newcount .gt. oldcount+1) then + linecount = linecount - 1 + oldcount = syncount + go to 100 + else + syncount = newcount + go to 5 + endif + endif + + +c keyword 'freeform' indicates whether or not the linelist will be read +c in under format control (7e10.3) or will be free-form. If freeform = 0, +c the default value, then the old-style formatted input will be used; +c If freeform = 1, unformatted read will be used, BUT the user must then +c give values for all quantities (that is, explicit zeros will need to +c be put instead of blank spaces. + if (keyword .eq. 'freeform') then + read (array,*) linfileopt + + +c keyword 'standard_out' controls the name of the verbose standard output + elseif (keyword .eq. 'standard_out') then + read (array,*) f1out + + +c keyword 'summary_out' controls the name of either the EW summary or +c the raw synthesis output + elseif (keyword .eq. 'summary_out') then + read (array,*) f2out + + +c keyword 'hardpost_out' controls the name of a postscript plot output + elseif (keyword .eq. 'hardpost_out') then + read (array,*) f5out + + +c keyword 'speccomp_out' controls the name of a text file containing the +c comparisons (wavelength shifts, sigmas, etc.) between observed and +c synthetic spectra + elseif (keyword .eq. 'speccomp_out') then + read (array,*) f6out + + +c keyword 'bin_raw_out' controls the name of a file containing the +c raw synthesis of a spectroscopic binary, with an appropriate velocity +c difference and luminosity ratio dialed in + elseif (keyword .eq. 'bin_raw_out') then + read (array,*) f9out + + +c keyword 'bin_smo_out' controls the name of a file containing the +c smoothed synthesis of a spectroscopic binary + elseif (keyword .eq. 'bin_smo_out') then + read (array,*) f10out + + +c keyword 'summary_in' controls the name of the raw synthesis file, +c created previously, that will be read in for plotting purposes + elseif (keyword .eq. 'summary_in') then + read (array,*) f2out + + +c keyword 'smoothed_out' controls the name of the smoothed synthesis output + elseif (keyword .eq. 'smoothed_out') then + read (array,*) f3out + + +c keyword 'keeplines_out' controls the name of the list of kept lines +c for future synthetic spectrum runs + elseif (keyword .eq. 'keeplines_out') then + read (array,*) f8out + + +c keyword 'tosslines_out' controls the name of the list of discarded lines +c that are too weak to keep in future synthetic spectrum runs + elseif (keyword .eq. 'tosslines_out') then + read (array,*) f9out + + +c keyword 'iraf_out' controls the name of the optional IRAF output + elseif (keyword .eq. 'iraf_out') then + read (array,*) f4out + + +c keyword 'model_in' controls the name of input model atmosphere file + elseif (keyword .eq. 'model_in') then + read (array,*) fmodel + + +c keyword 'lines_in' controls the name of the input line list + elseif (keyword .eq. 'lines_in') then + read (array,*) flines + + +c keyword 'stronglines_in' controls the name of the input strong line list + elseif (keyword .eq. 'stronglines_in') then + read (array,*) fslines + + +c keyword 'observed_in' controls the name of the input observed spectrum + elseif (keyword .eq. 'observed_in') then + read (array,*) fobs + + +c keyword 'table_in' controls the name of the extra input instruction file + elseif (keyword .eq. 'table_in ') then + read (array,*) ftable + + +c keyword 'table_out' controls the name of the extra input instruction file + elseif (keyword .eq. 'table_out ') then + read (array,*) f7out + + +c keyword 'popsyn_out' controls the name of the extra input instruction file + elseif (keyword .eq. 'popsyn_out ') then + read (array,*) f9out + + +c keyword 'rawbin_out ' controls the name of the input observed spectrum + elseif (keyword .eq. 'rawbin_out ') then + read (array,*) f9out + + +c keyword 'smoobin_out' controls the name of the input observed spectrum + elseif (keyword .eq. 'smoobin_out') then + read (array,*) f10out + + +c keyword 'atmosphere' controls the output of atmosphere quantities +c 0 = do not print out the atmosphere +c 1 = print out the standard things about an atmsophere +c 2 = print standard things and additional stuff like continuous +c opacities, etc. + elseif (keyword .eq. 'atmosphere') then + read (array,*) modprintopt + + +c keyword 'molecules ' controls the molecular equilibrium calculations +c 0 = do not do molecular equilibrium +c 1 = do molecular equilibrium but do not print results +c 2 = do molecular equilibrium and print results + elseif (keyword .eq. 'molecules') then + read (array,*) molopt + if (molopt .eq. 0) then + nchars = 64 + write (array,1009) + call getasci (nchars,l0) + if (chinfo(1:1) .eq. 'n') then + stop + else + molopt = 1 + endif + endif + + +c keyword 'molset' controls the choice of which set of molecules will be +c used in molecular equilibrium calculations. +c 1 = the small set involving H, C, N, O, Mg, Ti (DEFAULT) +c 2 = the large set more useful for very cool stars + elseif (keyword .eq. 'molset') then + read (array,*) molset + + +c keyword 'deviations' controls whether, for synthetic spectrum computations, +c an 'obs-comp' plot will be made in addition to the normal spectrum plot +c 0 = do not plot the obs-comp plot +c 1 = plot the obs-comp plot + elseif (keyword .eq. 'deviations') then + read (array,*) deviations + + +c keyword 'lines ' controls the output of line data +c 0 = print out nothing about the input lines +c 1 = print out standard information about the input line list +c 2 = gory line data print (usually for diagnostic purposes) + elseif (keyword .eq. 'lines') then + read (array,*) linprintopt + linprintalt = linprintopt + + +c keyword 'gfstyle ' controls the output of line data +c 0 = base-10 logarithms of the gf values (DEFAULT) +c 1 = straight gf values + elseif (keyword .eq. 'gfstyle') then + read (array,*) gfstyle + + +c keyword 'contnorm ' allows multiplicative adjustment of the +c continuum; useful probably only for batch syntheses +c the numbers employed should be around 1.0; +c default is 1.000000 + elseif (keyword .eq. 'contnorm') then + read (array,*) contnorm + + +c keyword 'plotpars ' allows you to set all of the plotting +c parameters if you know them in advance +c 0 = none set (default); user can change in plotting routine +c 1 = given in following lines as follows +c xlow xhi ylo yhi +c vshift lamshift obsadd obsmult +c smooth-type FWHM-Gauss vsini L.D.C. FWHM-Macro FWHM-Loren + elseif (keyword .eq. 'plotpars') then + read (array,*) iscale + if (iscale .ne. 0) then + read (nfparam,*) xlo, xhi, ylo, yhi + linecount = linecount + 1 + read (nfparam,*) veladd, xadd, yadd, ymult + if (xadd .ne. 0.) then + veladd = 3.0d5*xadd/((xlo+xhi)/2.) + xadd = 0. + endif + linecount = linecount + 1 + read (nfparam,*) smtype, fwhmgauss, vsini, limbdark, vmac, + . fwhmloren + linecount = linecount + 1 + endif + + +c keyword 'trudamp ' should moog use the detailed line damping for +c those transitions that have information stored in +c subroutine trudamp? (Default is *no*) + elseif (keyword .eq. 'trudamp') then + read (array,*) itru + + +c keyword 'veladjust ' shoud moog try to do a cross-correlation between +c observed and synthetic spectra and use that to +c align the spectra better in wavelength +c (Default is *no*) + elseif (keyword .eq. 'veladjust') then + read (array,*) maxshift + + +c keyword 'units ' controls the units in which moog +c outputs the final spectrum +c 0 = angs +c 1 = microns +c 2 = 1/cm + elseif (keyword .eq. 'units') then + read (array,*) iunits + if (iunits .ne. 0) then + write (*,1010) + stop + endif + + +c keyword 'iraf ' allows the user to output a raw spectrum in +c a form suitable for IRAF's rtext input command +c 0 = don't do this, make output the normal way. +c 1 = make an IRAF-compatible output + elseif (keyword .eq. 'iraf') then + read (array,*) iraf + + +c keyword 'scat 'allows the user to employ a source function +c which has both scattering and absorption components +c 0 = NO scattering +c 1 = scattering + elseif (keyword .eq. 'scat') then + read (array,*) scatopt + + +c keyword 'flux/int ' choses integrated flux or central intensity +c 0 = integrated flux calculations +c 1 = central intensity calculations + elseif (keyword .eq. 'flux/int') then + read (array,*) fluxintopt + + +c*****here are the calculations to set up the damping; for atomic lines +c there are several options: +c dampingopt = 0 and dampnum < 0 ---> +c gammav = 10^{dampnum(i)}*(T/10000K)^0.3*n_HI +c dampingopt = 0 and dampnum = 0 ---> +c c6 = Unsold formula +c dampingopt = 0 and dampnum > 10^(-10) ---> +c c6 = (Unsold formula)*dampnum(i) +c dampingopt = 0 and dampnum(i) < 10^(-10) ---> +c c6 = dampnum(i) +c dampingopt = 1 ---> +c gammav = gamma_Barklem if possible, +c otherwise use dampingopt=0 options +c dampingopt = 2 ---> +c c6 = c6_Blackwell-group +c dampingopt = 3 and dampnum <= 10^(-10) ---> +c c6 = c6_NEXTGEN for H I, He I, H2 +c dampingopt = 3 and dampnum > 10^(-10) ---> +c c6 = (c6_NEXTGEN for H I, He I, H2)*dampnum +c for molecular lines (lacking a better idea) ---> +c c6 done as in dampingopt = 0 + elseif (keyword .eq. 'damping') then + read (array,*) dampingopt + + +c keyword 'obspectrum' controls the file type of the observed spectrum +c 0 = no observed spectrum is to be input +c 1 = read a true FITS file with internal read statements +c -1 = as if obspectrum = 1, but on a byte-swapping machine +c 2 = (not implemented yet) +c 3 = read a true Fits file with the FITSIO package +c 4 = (not implemented yet) +c 5 = read a special MONGO style (wavelength, flux pair) file + elseif (keyword .eq. 'obspectrum') then + read (array,*) specfileopt + if (specfileopt .lt. 0) then + byteswap = 1 + specfileopt = iabs(specfileopt) + endif + + +c keyword 'histogram' makes histogram plots of observed spectra if +c histoyes = 1 + elseif (keyword .eq. 'histogram') then + read (array,*) histoyes + + +c keyword 'terminal ' gives the sm plotting window type +c smterm = a character string of the sm window type (see the +c appropriate sm manual for a list) + elseif (keyword .eq. 'terminal') then + read (array,*) smterm + + +c keyword 'plot ' decides whether or not to make a plot of results +c 0 = do not make a plot +c For syntheses: 1 = plot only synthetic spectra +c 2 = plot synthetic and observed spectra +c 3 = smooth the syntheses but don't plot +c For line analyses: # = the minimum number of lines of a +c species necessary to trigger a plot +c For curves-of-growth: 1 = make plots +c For flux curves: 1 = make plots + elseif (keyword .eq. 'plot') then + read (array,*) plotopt + + +c keyword 'abundances' gives the changes to be applied to the abundances +c # = the number of different syntheses to run +c (the next line gives the different abundance factors +c to use) +c minimum error check: numatomsyn must equal numisosyn or code will stop + elseif (keyword .eq. 'abundances') then + neq = 0 + numpecatom = 0 + numatomsyn = 0 + newnumpecatom = 0 + newnumatomsyn = 0 + ninetynineflag = 0 + do i=1,95 + pec(i) = 0 + newpec(i) = 0 + do j=1,5 + abfactor(j) = 0. + pecabund(i,j) = 0. + newpecabund(i,j) = 0. + enddo + enddo + read (array,*) numpecatom,numatomsyn + if (numisosyn .ne. 0) then + if (numatomsyn .ne. numisosyn) then + write (array,1002) numatomsyn, numisosyn + call putasci (77,6) + stop + endif + endif + do l=1,numpecatom + read (nfparam,*) jatom,(deltalogab(kk),kk=1,numatomsyn) + linecount = linecount + 1 + if (jatom .eq. 99) then + do kk=1,numatomsyn + abfactor (kk) = deltalogab(kk) + enddo + else + do kk=1,numatomsyn + pecabund(jatom,kk) = deltalogab(kk) + enddo + pec(jatom) = 1 + endif + enddo + if (numpecatom.eq.1 .and. jatom.eq.99) ninetynineflag = 1 + + +c keyword 'isotopes ' gives the isotopes used in the line list and their +c abundance relative to the parent spiecies +c minimum error check: numatomsyn must equal numisosyn or code will stop + elseif (keyword .eq. 'isotopes') then + numiso = 0 + numisosyn = 0 + newnumiso = 0 + newnumisosyn = 0 + do i=1,20 + isotope(i) = 0. + newisotope(i) = 0. + do j=1,5 + isoabund(i,j) = 0. + newisoabund(i,j) = 0. + enddo + enddo + read (array,*) numiso,numisosyn + if (numatomsyn .ne. 0) then + if (numatomsyn .ne. numisosyn) then + write (array,1002) numatomsyn, numisosyn + call putasci (77,6) + stop + endif + endif + do j=1,numiso + read (nfparam,*) isotope(j),(isoabund(j,kk),kk=1,numisosyn) + linecount = linecount + 1 + enddo + + +c keyword 'lumratio' gives the ratio of the luminosity of two stars at a +c specific wavelength in a binary star system (used +c only with driver "binary") + elseif (keyword .eq. 'lumratio') then + read (array,*) lumratio + + +c keyword 'deltaradvel' gives the velocity difference between the stars +c binary star system (used only with driver "binary") + elseif (keyword .eq. 'deltaradvel') then + read (array,*) deltaradvel + + +c keyword 'synlimits ' gives the wavelength parameters for syntheses; +c start and sstop are beginning and ending +c wavelengths, step is the step size in the +c syntheses, and delta is the wavelength range +c to either side of a synthesis point to consider +c for line opacity calculations + elseif (keyword .eq. 'synlimits') then + read (nfparam,*) start, sstop, step, delta + oldstart = start + oldstop = sstop + oldstep = step + olddelta = delta + step1000 = 1000.*step + if (dble(idnint(step1000))-step1000 .ne. 0.) then + write (*,1008) step + stop + endif + linecount = linecount + 1 + + +c keyword 'fluxlimits' gives the wavelength parameters for flux curves; +c start and sstop are beginning and ending +c wavelengths, and step is the step size in the +c flux curve + elseif (keyword .eq. 'fluxlimits') then + read (nfparam,*) start, sstop, step + linecount = linecount + 1 + + +c keyword 'blenlimits' gives the parameters for blended line abundance +c matches. delwave is the wavelength offset +c to the blue of first and to the red of the +c last line in the blend to extend the syntheses; +c step is the wavelength step size in the +c computations; cogatom is the name of the +c element whose abundance should be varied +c to achieve an EW match with observations. + elseif (keyword .eq. 'blenlimits') then + read (nfparam,*) delwave, step, cogatom + linecount = linecount + 1 + + +c keyword 'coglimits ' gives the log(W/lambda) limits for curves-of-growth +c rwlow and rwhigh are the beginning +c and ending points of the log(red.width) values, +c rwstep is the step in log(red.width), +c cogatom is the declaration of which element +c will have its abundance varied (necessary only +c for spectrum synthesis curves-of-growth, +c and wavestep is a forced (if desired) step size +c in wavelength along the line (this applies to +c single line computations only + elseif (keyword .eq. 'coglimits') then + read (nfparam,*) rwlow, rwhigh, rwstep, wavestep, cogatom + linecount = linecount + 1 + + +c keyword 'limits ' old limits format...tell the user to change the +c keyword and quit. + + elseif (keyword .eq. 'limits') then + write(*,*) 'Warning: keyword changed to *synlimits*, *coglimits*' + write(*,*) 'for Syntesis and COG calculations.' + write(*,*) 'Here are the proper formats:' + write(*,*) + write(*,*) 'synlimits <start> <stop> <step> <delta>' + write(*,*) 'coglimits <rwlow> <rwhigh> <rwstep> <wavestep> ', + . '<cogatom>' + stop + + +c keyword of strong for lines which are to be considered for all of the +c synthesis + elseif (keyword .eq. 'strong') then + read (array,*) dostrong + + +c keyword word of opacit which takes the continuus opacity and scales it +c with the form of kaplam(i)= kaplam(i)*((factor*10000)/t(i)) +c in Opacit.f after it calulates the normal kaplam +c if value is <= 0 then it does not do it + elseif (keyword .eq. 'opacit') then + read (array,*) fudge + + +c any other keyword causes great grudge + else + write (array,1006) keyword + call prinfo (5) + stop + + endif + + +c loop back to get another parameter + go to 5 + + +c wrap things up with a few assignments +98 if (control.eq.'gridsyn' .or. control.eq.'gridplo' .or. + . control.eq.'binary ' .or. control.eq.'abandy ') then + control = 'gridend' + endif + + +c assign plotting window type; if no type has been given in the +c parameter file, then ask for it +100 if (smterm .eq. ' ') then + array = 'GIVE THE SM TERMINAL NAME : ' + nchar = 28 + call getasci (nchar,12) + smterm = chinfo(1:nchar) + ivstat = ivcleof(12,1) + endif + if (smterm.eq.'x11' .or. smterm.eq.'X11') then + if (control .eq. 'synth ' .or. + . control .eq. 'synpop ' .or. + . control .eq. 'synplot' .or. + . control .eq. 'isoplot' .or. + . control .eq. 'gridsyn' .or. + . control .eq. 'gridplo' .or. + . control .eq. 'doflux ' .or. + . control .eq. 'cogsyn ' .or. + . control .eq. 'cog ' .or. + . control .eq. 'isotop ' .or. + . control .eq. 'binary ') then + smterm = smt1 + else + smterm = smt2 + endif + endif + + +c for syntheses, store the plotting parameters + if (control.eq.'synth ' .or. control.eq.'synplot' .or. + . control.eq.'gridsyn' .or. control.eq.'gridplo' .or. + . control.eq.'binary ' .or. control.eq.'synpop ') then + if (oldstart .eq. 0) then + write (*,1011) + stop + endif + if (iscale .eq. 0) call plotremember (0) + call plotremember (1) + endif + + +c*****exit normally + return + + +c*****format statements +1001 format (a80) +1002 format ('# OF ABUNDANCE (',i1,') AND ISOTOPIC (',i1,')', + . ' SYNTHESES DO NOT AGREE! I QUIT! ') +1006 format ('THIS OPTION IS UNKNOWN TO MOOG: ', a10, ' I QUIT!') +1007 format (79(' ')) +1008 format ('step =', f10.5, 'A but it cannot be more precise than ', + . 'the nearest 0.001A; I QUIT!') +1009 format ('WARNING: molecular eq. always done if ', + . 'Teff < 8000K; OK (y/n)???') +1010 format ('the units=1 option is fragile; rerun with only ', + . 'Angstroms and units=0') +1011 format ('SYNTHESIS START NOT SET; I QUIT!') + + end + + + + + + diff --git a/Partfn.f b/Partfn.f new file mode 100755 index 0000000..5463afb --- /dev/null +++ b/Partfn.f @@ -0,0 +1,42 @@ + + subroutine partfn (atom,jmark) +c****************************************************************************** +c This routine computes arrays or single partition functions; +c It uses the data and formulation of Kurucz's ATLAS9 program. +c However, the partition functions have been updated for several species, +c and those are calculated in subroutine *newpart*. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Quants.com' + + + iat = 10*nint(atom) - 1 + at = dfloat(iat)/10. + iatom = nint(atom) + + +c*****compute partition functions for 4 ionization states of an element. + do k=1,4 + iat = iat + 1 + at = dfloat(iat)/10. + if (partflag(iatom,k) .gt. 0) then + do i=1,ntau + u(jmark,k,i) = partnew(at,k,i) + enddo + else + do i=1,ntau + u(jmark,k,i) = ucalc(at,i) + enddo + endif + enddo + + + return + end + + + + diff --git a/Partnew.f b/Partnew.f new file mode 100755 index 0000000..7b9e0f3 --- /dev/null +++ b/Partnew.f @@ -0,0 +1,40 @@ + + real*8 function partnew (atom,k,level) +c****************************************************************************** +c This routine computes partition functions for those species that have +c been updated from those that are in ATLAS9. The polynomial +c representations are in the form used by Irwin (1981, ApJS, 45, 621): +c log10(U) = SUM{C_j*log10(T)**(j-1)} for j = 1-->6 +c where T = temperature and C_j are the six polynomial coefficients. +c Information on the updated partition functions are given by +c Lawler & Sneden (2002, in preparation). This routine will be +c increasingly invoked as new new data are added to the *newpartdata* +c array, until a full replacement for the older partition functions +c is implemented. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Quants.com' + + + iatom = nint(atom) + iarray = partflag(iatom,k) + + if (level .gt. 500) then + temp = dlog(dble(level)) + else + temp = tlog(level) + endif + + ulog = 0. + do j=1,6 + ulog = ulog + newpartdata(iarray,j)*temp**(j-1) + enddo + partnew = dexp(ulog) + + return + end + + + diff --git a/Plotit.f b/Plotit.f new file mode 100755 index 0000000..ac7277c --- /dev/null +++ b/Plotit.f @@ -0,0 +1,85 @@ + + subroutine plotit +c****************************************************************************** +c This routine plots a spectrum that already has been synthesized +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Pstuff.com' + + +c*****examine the parameter file + call params + + +c*****open the files for: raw spectrum depths (as input), smoothed +c spectra (output), and (if desired) IRAF-style smoothed spectra (output) + nf2out = 21 + lscreen = 4 + array = 'RAW SYNTHESES INPUT' + nchars = 19 + call infile ('input ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + if (plotopt .ne. 0) then + nf3out = 22 + lscreen = lscreen + 2 + array = 'SMOOTHED SYNTHESES OUTPUT' + nchars = 25 + call infile ('output ',nf3out,'formatted ',0,nchars, + . f3out,lscreen) + nf5out = 26 + lscreen = lscreen + 2 + array = 'POSTSCRIPT PLOT OUTPUT' + nchars = 22 + call infile ('output ',nf5out,'formatted ',0,nchars, + . f5out,lscreen) + endif + if (plotopt .gt. 1) then + nf6out = 27 + lscreen = lscreen + 2 + array = 'SPECTRUM COMPARISON OUTPUT' + nchars = 27 + call infile ('output ',nf6out,'formatted ',0,nchars, + . f6out,lscreen) + endif + if (iraf .ne. 0) then + nf4out = 23 + lscreen = lscreen + 2 + array = 'IRAF ("rtext") OUTPUT' + nchars = 24 + call infile ('output ',nf4out,'formatted ',0,nchars, + . f4out,lscreen) + endif + + +c*****now plot the spectrum + if (plotopt.eq.2 .and. specfileopt.gt.0) then + nfobs = 33 + lscreen = lscreen + 2 + array = 'THE OBSERVED SPECTRUM' + nchars = 21 + if (specfileopt.eq.1 .or. specfileopt.eq.3) then + call infile ('input ',nfobs,'unformatted',2880,nchars, + . fobs,lscreen) + else + call infile ('input ',nfobs,'formatted ',0,nchars, + . fobs,lscreen) + endif + endif + if (plotopt .ne. 0) then + line = 10 + ncall = 1 + call pltspec (line,ncall) + endif + + +c*****finish + call finish (0) + return + + + end + + + diff --git a/Plotremember.f b/Plotremember.f new file mode 100755 index 0000000..5f1619f --- /dev/null +++ b/Plotremember.f @@ -0,0 +1,123 @@ + + subroutine plotremember (option) +c****************************************************************************** +c This subroutine declares or stores or recovers the plotting parameters +c that were default, or set in the parameter file or were the ones used +c in the most recent call to a plotting routine. +c****************************************************************************** + + include 'Linex.com' + include 'Pstuff.com' + integer option + + +c*****initialize the plot parameters; iscale=0 is simple default; +c iscale=1 is when these parameters have been read from the +c parameter file + if (option .eq. 0) then + if (iscale .eq. 0) then + xlo = oldstart + xhi = oldstop + ylo = 0. + yhi = 1.1 + veladd = 0. + xadd = 0. + yadd = 0. + ymult = 1. + smtype = 'g' + fwhmgauss = 0.1 + vsini = 0. + limbdark = 0. + vmac = 0. + fwhmloren = 0. + whichwin = '1of1' + endif + + +c*****store the original plot parameters + elseif (option .eq. 1) then + origxlo = xlo + origxhi = xhi + origylo = ylo + origyhi = yhi + origveladd = veladd + origxadd = xadd + origyadd = yadd + origymult = ymult + origsmtype = smtype + origfwhmgauss = fwhmgauss + origvsini = vsini + origlimbdark = limbdark + origvmac = vmac + origfwhmloren = fwhmloren + origwhichwin = whichwin + + +c*****re-set the plot parameters to their original values + elseif (option .eq. 2) then + xlo = origxlo + xhi = origxhi + ylo = origylo + yhi = origyhi + veladd = origveladd + xadd = origxadd + yadd = origyadd + ymult = origymult + smtype = origsmtype + fwhmgauss = origfwhmgauss + vsini = origvsini + limbdark = origlimbdark + vmac = origvmac + fwhmloren = origfwhmloren + whichwin = origwhichwin + + +c*****store the plot parameters from the last entry into pltspec + elseif (option .eq. 3) then + oldxlo = xlo + oldxhi = xhi + oldylo = ylo + oldyhi = yhi + oldveladd = veladd + oldxadd = xadd + oldyadd = yadd + oldymult = ymult + oldsmtype = smtype + oldfwhmgauss = fwhmgauss + oldvsini = vsini + oldlimbdark = limbdark + oldvmac = vmac + oldfwhmloren = fwhmloren + oldwhichwin = whichwin + + +c*****re-set plot parameters to values from the last entry into pltspec + elseif (option .eq. 4) then + xlo = oldxlo + xhi = oldxhi + ylo = oldylo + yhi = oldyhi + veladd = oldveladd + xadd = oldxadd + yadd = oldyadd + ymult = oldymult + smtype = oldsmtype + fwhmgauss = oldfwhmgauss + vsini = oldvsini + limbdark = oldlimbdark + vmac = oldvmac + fwhmloren = oldfwhmloren + whichwin = oldwhichwin + else + stop 'bad option in plotremember; I quit!' + endif + + + return + end + + + + + + diff --git a/Plotval.com b/Plotval.com new file mode 100755 index 0000000..8e5320d --- /dev/null +++ b/Plotval.com @@ -0,0 +1,6 @@ + common /plotval/ xleft,right,up,down,oldlft,oldrgt,oldup,olddown, + . xmax,xmin,ixlcnt,iylcnt,realcolors(50) + + real*4 xleft,right,up,down,oldlft,oldrgt,oldup,olddown, + . xmax,xmin,realcolors + diff --git a/Pltabun.f b/Pltabun.f new file mode 100755 index 0000000..5fc7691 --- /dev/null +++ b/Pltabun.f @@ -0,0 +1,64 @@ + + subroutine pltabun +c****************************************************************************** +c This subroutine controls the decisions that are made around the +c plotting of individual line abundances +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Pstuff.com' + real*8 xnum + real*4 shortnum + + + if (kount .ge. plotopt) then + if (plotopt .eq. 0) return +10 choice = 'y' + plotroutine = 'term_port_abun' + lscreen = maxline -2 + call makeplot (lscreen) + array = 'WHAT TO DO NEXT ([n]/h/f/r/m/v)? ' + lscreen = lscreen + 2 + nchars = 35 + call getasci (nchars,maxline) + choice = chinfo(1:1) + if (choice.eq.'n' .or. nchars.le.0) then + return + elseif (choice .eq. 'm') then + return + elseif (choice .eq. 'v') then + write (array,*) 'What is the new microturbulence (km/s)? ' + nchars = 41 + call getnum (nchars,lscreen,xnum,shortnum) + do i=1,ntau + vturb(i) = xnum*1.0e5 + enddo + write (moditle(57:64),1010) xnum + lim1line = 0 + lim2line = 0 + lim1obs = 0 + lim2obs = 0 + return + elseif (choice .eq. 'h') then + plotroutine = 'hard_port_abun' + call makeplot (lscreen) + elseif (choice .eq. 'r') then + go to 10 + elseif (choice .eq. 'f') then + plotroutine = 'file_port_abun' + call makeplot (lscreen) + endif + endif + + + return + + +c*****format statements +1010 format ('vt=',f5.2) + end + + diff --git a/Pltcog.f b/Pltcog.f new file mode 100755 index 0000000..0d53d0e --- /dev/null +++ b/Pltcog.f @@ -0,0 +1,77 @@ + + subroutine pltcog +c****************************************************************************** +c This subroutine controls the decisions that are made around the +c plots of curves-of-growth +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Pstuff.com' + real*8 xnum + real*4 shortnum + + +c call up the curve-of-growth plot + if (plotopt .eq. 0) return +10 choice = 'y' + plotroutine = 'term_land_cog ' + lscreen = 12 + whichwin = '1of1' + call makeplot (lscreen) + + +c make a hardcopy, write to a postscript file, point at a place on the +c screen, try a new model atmosphere, or replot? +1 array = 'WHAT TO DO NEXT ([n]/h/f/p/v/m/r)? ' + lscreen = 12 + nchars = 37 + call getasci (nchars,lscreen) + choice = chinfo(1:1) + if (choice.eq.'n' .or. nchars.le.0) then + return + elseif (choice .eq. 'h') then + plotroutine = 'hard_land_cog ' + call makeplot (lscreen) + go to 10 + elseif (choice .eq. 'v') then + write (array,*) 'What is the new microturbulence (km/s)? ' + nchars = 41 + lscreen = lscreen + 2 + call getnum (nchars,lscreen,xnum,shortnum) + do i=1,ntau + vturb(i) = xnum*1.0e5 + enddo + write (moditle(57:64),1010) xnum + rewind nf1out + rewind nf2out + rewind nfmodel + rewind nflines + return + elseif (choice .eq. 'm') then + return + elseif (choice .eq. 'r') then + go to 10 + elseif (choice .eq. 'p') then + array = 'MARK THE POSITION WITH THE CURSOR' + istat=ivcleof(21,1) + istat=ivwrite(13,3,array,34) + call drawcurs + go to 1 + elseif (choice .eq. 'f') then + plotroutine = 'file_land_cog ' + call makeplot (lscreen) + go to 10 + endif + return + + +c*****format statements +1010 format ('vt=',f5.2) + + + end + + + + diff --git a/Pltflux.f b/Pltflux.f new file mode 100755 index 0000000..5332f45 --- /dev/null +++ b/Pltflux.f @@ -0,0 +1,45 @@ + + subroutine pltflux +c****************************************************************************** +c This subroutine controls the decisions that are made around the +c plots of flux curves +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + + +c call up the flux plot + if (plotopt .eq. 0) return +10 choice = 'y' + plotroutine = 'term_land_flux' + lscreen = 12 + call makeplot (lscreen) + + +c make a hardcopy, write to a postscript file, or replot? + array = 'WHAT TO DO NEXT ([n]/h/f/r)? ' + lscreen = 12 + nchars = 33 + call getasci (nchars,lscreen) + choice = chinfo(1:1) + if (choice.eq.'n' .or. nchars.le.0) then + return + elseif (choice .eq. 'h') then + plotroutine = 'hard_land_flux' + call makeplot (lscreen) + elseif (choice .eq. 'r') then + go to 10 + elseif (choice .eq. 'f') then + plotroutine = 'file_land_flux' + call makeplot (lscreen) + endif + + return + end + + + + diff --git a/Pltspec.f b/Pltspec.f new file mode 100755 index 0000000..5396d94 --- /dev/null +++ b/Pltspec.f @@ -0,0 +1,418 @@ + + + subroutine pltspec (line,ncall) +c****************************************************************************** +c This subroutine controls the plotting of the synthesized and +c observed data +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Equivs.com' + real*8 xnum + real*4 yyadd, xxadd, vveladd, yymult + integer ncall + + +c*****initialize some variables, or re-set them to old values +3 if (ncall .eq. 1) then + if (iscale .eq. 0) then + choice = 's' + else + choice = '1' + endif + else + call plotremember (4) + endif + + +c*****make a special "choice" for grid syntheses, which go directly to +c*****postscript files if desired + if (control.eq.'gridsyn' .or. control.eq.'gridend' .or. + . control.eq.'gridplo') then + choice = 'g' + endif + + +c*****begin by reading in an observed spectrum + if (specfileopt.ge.1 .and. plotopt.eq.2 .and. ncall.eq.1) then + call readobs (line) + if (lount .eq. -1) then + array = 'OBSERVED SPECTRUM FILE PROBLEM! I QUIT.' + istat = ivwrite (line+4,3,array,40) + stop + endif + endif + + +c*****go through the option list; the routine may be exited at this point + istat = ivcleof(4,1) +1 if (choice .eq. 'q') return + + +c*****or a default plot may be made upon entering the routine + if (choice.eq.'1' .or. choice.eq.'g') then +c*****make a cross correlation to line up synthetic and observed spectra +c*****in velocity (wavelength) space; the user can turn this off/on +c*****not working for you + call smooth (-1,ncall) +c---------------------------------------------------------------------------- + if (plotopt.eq.2 .and. ncall.eq.1) then + vfactor = 1.0 + veladd/2.99795e+5 + do i=1,lount + xobs(i) = vfactor*xobs(i) + enddo + if (maxshift .gt. 0) then + call correl (maxshift) + vfactor = 1.0 + deltavel/2.99795e+5 + do i=1,lount + xobs(i) = vfactor*xobs(i) + enddo + endif + endif +c---------------------------------------------------------------------------- + if (ncall .eq. 1) then + wmiddle = (start + sstop)/2. + if (iunits .eq. 1) wmiddle = 1.d-4*wmiddle + if (ymult .eq. 0.0) ymult = 1.0 + do i=1,lount + yobs(i) = ymult*yobs(i) + yobs(i) = yadd+yobs(i) + enddo + if (xlo .eq. xhi) then + xlo = start + xhi = sstop + if (iunits .eq. 1) then + xlo = 1.d-4*xlo + xhi = 1.d-4*xhi + endif + endif + if (ylo .eq. yhi) then + ylo = 0. + yhi = 1.1 + endif + endif + call boxit + endif + + +c*****or the synthetic spectra may be resmoothed; if a problem develops in +c a user-specified parameter (like a Gaussian FWHM that is too large), +c then output a warning and let user decide what to do next + if (choice .eq. 's') then + call smooth (line+2,1) +2 if (smtype .eq. 'e') then + array = 'REDO THE SMOOTHING (y/n)? ' + nchars = 26 + call getasci (nchars,line+9) + smtype = chinfo(1:1) + if (smtype .eq. 'n') then + go to 100 + else + istat = ivcleof (10,1) + go to 2 + endif + endif + if (xlo .eq. 0.0 .and. xhi .eq. 0.0) then + xlo = start + xhi = sstop + if (iunits .eq. 1) then + xlo = 1.d-4*xlo + xhi = 1.d-4*xhi + endif + endif + endif + + +c*****or the observations may be rescaled + if (choice .eq. 'r') then + array = 'MULTIPLY THE OBSERVED POINTS BY WHAT FACTOR? ' + nchars = 45 + call getnum (nchars,13,xnum,yymult) + ymult = ymult*yymult + do i=1,lount + yobs(i) = yymult*yobs(i) + enddo + endif + + +c*****or the observations may be shifted by an additive constant + if (choice .eq. 'a') then + array = 'ADD WHAT NUMBER TO THE OBSERVED POINTS? ' + nchars = 40 + call getnum (nchars,13,xnum,yyadd) + yadd = yadd + yyadd + do i=1,lount + yobs(i) = yyadd + yobs(i) + enddo + endif + + +c*****or the observations may be shifted by a constant wavelength + if (choice .eq. 'w') then + array = 'SHIFT THE OBSERVED POINTS BY WHAT WAVELENGTH? ' + nchars = 46 + call getnum (nchars,13,xnum,xxadd) + wfactor = xxadd/((start+sstop)/2.) + veladd = veladd + wfactor*2.99795d+5 + vfactor = 1.0 + wfactor + do i=1,lount + xobs(i) = vfactor*xobs(i) + enddo + endif + + +c*****or the observations may be shifted by a constant velocity + if (choice .eq. 'v') then + array = 'SHIFT THE OBSERVED POINTS BY WHAT VELOCITY (KM/S)? ' + nchars = 51 + call getnum (nchars,13,xnum,vveladd) + veladd = veladd + vveladd + vfactor = 1.0 + vveladd/2.99795d+5 + do i=1,lount + xobs(i) = vfactor*xobs(i) + enddo + endif + + +c*****or the plot boundaries may be changed + if (choice .eq. 'c') then + write (array,1001) xlo + nchars = 29 + call getnum (nchars,15,xnum,xlo) + write (array,1002) xhi + nchars = 30 + call getnum (nchars,15,xnum,xhi) + write (array,1003) ylo + nchars = 34 + call getnum (nchars,15,xnum,ylo) + write (array,1004) yhi + nchars = 31 + call getnum (nchars,15,xnum,yhi) + call boxit + endif + + +c*****or the cross hairs can be used to zoom in on a part of the plot + if (choice .eq. 'z') then + array = 'MARK THE LOWER LEFT HAND CORNER WITH THE CURSOR' + istat = ivcleof(13,1) + istat = ivwrite(13,3,array,47) + call pointcurs + xlo = xplotpos + ylo = yplotpos + array = 'MARK THE UPPER RIGHT HAND CORNER WITH THE CURSOR' + istat = ivcleof(14,1) + istat = ivwrite (14,1,array,48) + call pointcurs + xhi = xplotpos + yhi = yplotpos + call boxit + if (iunits .eq. 1) then + xlo = 1.d-4*xlo + xhi = 1.d-4*xhi + endif + whichwin = '1of1' + endif + + + +c*****or cursor position can be returned + if (choice .eq. 'p') then + array = 'MARK THE POSITION WITH THE CURSOR' + istat=ivcleof(21,1) + istat=ivwrite(13,3,array,34) + call drawcurs + go to 100 + endif + + +c*****or the title of the model can be changed + if (choice .eq. 't') then + array = 'ENTER THE NEW TITLE' + istat = ivcleof(21,1) + istat = ivwrite (13,3,array,19) + read (*,1005) moditle + endif + + +c*****or the spectra can be replotted, with a separate plot showing the +c observed/synthtic spectrum differences + if (choice .eq. 'd') then + deviations = 1 + whichwin = '2of2' + endif + + +c*****or the plot boundaries may be reset to the original values; +c this is a basic starting over plot + if (choice .eq. 'o') then + xlo = start + xhi = sstop + if (iunits .eq. 1) then + xlo = 1.d-4*xlo + xhi = 1.d-4*xhi + endif + xlo = origxlo + xhi = origxhi + ylo = origylo + yhi = origyhi + lim1obs = 1 + lim2obs = lount + deviations = 0 + call boxit + endif + + +c*****or the plot can simply be redone + if (choice .eq. 'm') then + go to 90 + endif + + +c*****now either here make a hardcopy plot + if (choice .eq. 'h') then + if (control .eq. 'binary ') then + plotroutine = 'hard_land_bin ' + else + plotroutine = 'hard_land_spec' + endif + if (deviations .eq. 0) then + whichwin = '1of1' + else + whichwin = '2of2' + endif + lscreen = 12 + call makeplot (lscreen) + go to 100 + endif + + +c*****or write the plot to a postscript file + if (choice.eq.'f' .or. choice.eq.'g') then + if (control .eq. 'binary ') then + plotroutine = 'file_land_bin ' + else + plotroutine = 'file_land_spec' + endif + if (deviations .eq. 0) then + whichwin = '1of1' + else + whichwin = '2of2' + endif + lscreen = 12 + call makeplot (lscreen) + if (choice .eq. 'g') then + return + else + go to 90 + endif + endif + + +c*****or return to the calling routine in order to change abundances + if (choice .eq. 'n') then + call plotremember (3) + return + endif + + +c*****or add an additional uniform amount of flux, expressed in terms of +c the current continuum flux; this only is approximately physically +c correct if spectrograph smoothing is negligible compared to other +c smoothing + if (choice .eq. 'l') then + write (array,*) + . 'WHAT IS THE ADDITIONAL FLUX IN TERMS OF CONTINUUM [0.0]? ' + nchars = 57 + call getnum (nchars,15,xnum,addflux) + call smooth (-1,ncall) + endif + + +c*****or if total confusion has happened in the plotting, reset all parameters +c to their original values, and replot + if (choice .eq. 'u') then + call plotremember (2) + ncall = 1 + go to 3 + endif + + +c*****or plot on the terminal +90 if (control.eq.'gridsyn' .or. control.eq.'gridend' .or. + . control .eq. 'gridplo') return + if (control .eq. 'binary ') then + plotroutine = 'term_land_bin ' + else + plotroutine = 'term_land_spec' + endif + lscreen = 12 + if (choice.eq.'f' .or. choice.eq.'h') choice = 'm' + if (deviations .eq. 0) then + whichwin = '1of1' + else + whichwin = '2of2' + endif + call makeplot (lscreen) + + +c*****finally, print the option table +100 istat = ivcleof (5,1) + array = 'OPTIONS? s=new smoothing r=rescale obs. ' + istat = ivwrite (5,3,array,48) + array = ' a=add # to obs. h=hardcopy ' + istat = ivwrite (6,3,array,48) + array = ' c=change bounds q=quit ' + istat = ivwrite (7,3,array,48) + array = ' m=redo same plot o=orig. plot bounds' + istat = ivwrite (8,3,array,51) + array = ' v=velocity shift w=wavelength shift ' + istat = ivwrite (9,3,array,51) + array = ' z=zoom in on plot p=cursor position ' + istat = ivwrite (10,3,array,51) + array = ' t=change title f=postscript file ' + istat = ivwrite (11,3,array,51) + array = ' n=new abundances d=obs/syn deviation' + istat = ivwrite (12,3,array,51) + array = ' l=add veiling u=undo all; replot ' + istat = ivwrite (13,3,array,51) + array = 'What is your choice? ' + nchars = 21 + call getasci (nchars,15) + choice = chinfo(1:1) + + +c*****reprint the option table if the choice is not understood +c or take action on the choice + if (choice.eq.'s' .or. choice.eq.'r' .or. + . choice.eq.'a' .or. choice.eq.'h' .or. + . choice.eq.'c' .or. choice.eq.'q' .or. + . choice.eq.'m' .or. choice.eq.'o' .or. + . choice.eq.'v' .or. choice.eq.'w' .or. + . choice.eq.'z' .or. choice.eq.'p' .or. + . choice.eq.'t' .or. choice.eq.'f' .or. + . choice.eq.'n' .or. choice.eq.'d' .or. + . choice.eq.'l' .or. choice.eq.'u') then + go to 1 + else + go to 100 + endif + + +c*****format statements +1001 format ('LEFT WAVELENGTH (',f9.2,'): ') +1002 format ('RIGHT WAVELENGTH (',f9.2,'): ') +1003 format ('BOTTOM RELATIVE FLUX (',f9.2,'): ') +1004 format ('TOP RELATIVE FLUX (',f9.2,'): ') +1005 format(a80) + + + end + + + + + diff --git a/Pointcurs.f b/Pointcurs.f new file mode 100755 index 0000000..d4bb692 --- /dev/null +++ b/Pointcurs.f @@ -0,0 +1,27 @@ + + subroutine pointcurs +c****************************************************************************** +c This subroutine returns the cursor position upon a click +c****************************************************************************** + + include 'Pstuff.com' + integer ichr + + + call sm_graphics + if (whichwin .eq. '1of1') then + call sm_window (1,1,1,1,1,1) + elseif (whichwin .eq. '2of2') then + call sm_defvar ('y_gutter','0.0') + call sm_window (1,2,1,1,1,1) + endif + call sm_curs (xplotpos,yplotpos,ichr) + call sm_gflush + call sm_alpha + + + return + end + + + diff --git a/Prinfo.f b/Prinfo.f new file mode 100755 index 0000000..9bc9295 --- /dev/null +++ b/Prinfo.f @@ -0,0 +1,58 @@ + + subroutine prinfo (line) +c****************************************************************************** +c this routine prints out information on the text terminal +c****************************************************************************** + + include 'Pstuff.com' + include 'Atmos.com' + character errm1*80,array1*80 + + +c*****do not print out information in real time if the code is in +c batch mode + if (silent .eq. 'y') return + + + if (line .eq. 1) then + istat = ivcleof(4,1) + endif + + if (line .eq. maxline-5) then + errm1 = errmess + array1 = array +10 array = 'WANT TO SEE MORE ([y]/n)? ' + nchars = 26 + call getasci (nchars,4+line) + if (chinfo(1:1).eq.'y' .or. nchars.le.0) then + istat = ivcleof(4,1) + line = 1 + array = array1 + errmess = errm1 + elseif (chinfo(1:1) .eq. 'n') then + errmess = 'stopinfo!' + return + else + go to 10 + endif + endif + + + istat = ivwrite(4+line,1,array,79) + errmess = 'everything OK' + return + + + end + + + + + + + + + + + + diff --git a/Pstuff.com b/Pstuff.com new file mode 100755 index 0000000..c261690 --- /dev/null +++ b/Pstuff.com @@ -0,0 +1,76 @@ + +c****************************************************************************** +c these common block holds parameters and arrays need in the +c plotting routines; the second common block puts character variables +c in their own separate common statement. +c****************************************************************************** + + real*8 xxm1, xxb1, xxr1, xxm2, xxb2, xxr2, + . xxm3, xxb3, xxr3, + . deltaep, deltarw, deltawv, + . p(1000), prot(1000), pmac(1000), + . vsini, limbdark, vmac, + . fwhmgauss, fwhmloren, + . oldvsini, oldlimbdark, oldvmac, + . oldfwhmgauss, oldfwhmloren, + . origvsini, origlimbdark, origvmac, + . origfwhmgauss, origfwhmloren, + . half, power, powerrot, powermac, + . average, deviate, oldhalf + real*4 xobs(500000), yobs(500000) + real*4 xlo, xhi, ylo, yhi, + . origxlo, origxhi, origylo, origyhi, + . oldxlo, oldxhi, oldylo, oldyhi, + . xadd, yadd, ymult, veladd, deltavel, + . origxadd, origyadd, origymult, origveladd, + . oldxadd, oldyadd, oldymult, oldveladd, + . bigxtic, bigytic, smlxtic, smlytic, + . xplotpos, yplotpos, addflux, ydelta + integer lount, kount, nsyn, lim1obs, lim2obs, + . iterm, iscale, maxline, histoyes, deviations, + . syncount, kounter, maxshift + + character*400 abitle + character*240 isoitle + character*80 smterm, smtotalterm, smt1, smt2 + character*80 moditle, obsitle, linitle, smitle, popitle, + . array, chinfo, errmess, plotroutine + character*4 whichwin, origwhichwin, oldwhichwin + character*1 choice, smtype, oldsmtype, origsmtype, + . gaussflag, rotateflag, lorenflag, macroflag + + common/pstuff/xxm1, xxb1, xxr1, xxm2, xxb2, xxr2, + . xxm3, xxb3, xxr3, + . deltaep, deltarw, deltawv, + . p, prot, pmac, + . vsini, limbdark, vmac, + . fwhmgauss, fwhmloren, + . oldvsini, oldlimbdark, oldvmac, + . oldfwhmgauss, oldfwhmloren, + . origvsini, origlimbdark, origvmac, + . origfwhmgauss, origfwhmloren, + . half, power, powerrot, powermac, + . average, deviate, oldhalf, + . xobs, yobs, + . xlo, xhi, ylo, yhi, + . origxlo, origxhi, origylo, origyhi, + . oldxlo, oldxhi, oldylo, oldyhi, + . xadd, yadd, ymult, veladd, deltavel, + . origxadd, origyadd, origymult, origveladd, + . oldxadd, oldyadd, oldymult, oldveladd, + . bigxtic, bigytic, smlxtic, smlytic, + . xplotpos, yplotpos, addflux, ydelta, + . lount, kount, nsyn, lim1obs, lim2obs, + . iterm, iscale, maxline, histoyes, deviations, + . syncount, kounter, maxshift + + common/cstuff/abitle, isoitle, + . smterm, smtotalterm, smt1, smt2, + . moditle, obsitle, linitle, smitle, popitle, + . array, chinfo, errmess, plotroutine, + . whichwin, origwhichwin, oldwhichwin, + . choice, smtype, oldsmtype, origsmtype, + . gaussflag, rotateflag, lorenflag, macroflag + + + diff --git a/Putasci.f b/Putasci.f new file mode 100755 index 0000000..d69f046 --- /dev/null +++ b/Putasci.f @@ -0,0 +1,28 @@ + + subroutine putasci (num,line) +c****************************************************************************** +c this routine prints out the characters contained in 'array' +c****************************************************************************** + + include 'Pstuff.com' + + istat = ivmove(line-1,1) + istat = ivcleol() + istat = ivmove(line-1,1) + write (errmess,1001) num + write (*,errmess) array + return + + +c*****format statements +1001 format ('(a',i2,'$)') + + + end + + + + + + + diff --git a/Quants.com b/Quants.com new file mode 100755 index 0000000..d7c683d --- /dev/null +++ b/Quants.com @@ -0,0 +1,13 @@ + +c****************************************************************************** +c this common block holds the internally-stored atomic data +c****************************************************************************** + + real*8 xsolar(95), xam(95), newpartdata(50,6), + . xchi1(95), xchi2(95), xchi3(95) + integer nudata(6,380), partflag(95,4), nu + + common/quants/xsolar, xam, newpartdata, + . xchi1, xchi2, xchi3, + . nudata, partflag, nu + diff --git a/Readobs.f b/Readobs.f new file mode 100755 index 0000000..c8004a9 --- /dev/null +++ b/Readobs.f @@ -0,0 +1,192 @@ + + subroutine readobs (line) +c****************************************************************************** +c this routine reads in observed spectra. the format is indicated by +c the value of "specfileopt" +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Equivs.com' + include 'Obspars.com' + byte int1(2880), onebyte + integer*2 int2(1440) + integer*4 int4(720) + real*4 real4(720) + real*4 xtemp, ytemp + equivalence (int1,int2,int4,real4) + character head*2880 + + +c*****first set some initial parameters + write (obsitle,1021) + iend = 0 + naxis = 1 + naxis1 = 0 + bscale = 0. + bzero = 0. + do j=1,9 + disp(j) = 0. + enddo + + +c*****branch to the appropriate data file type + go to (100,200,300,400,500), specfileopt + + +c*****here is a pure FITS file type. Reading is done with ordinary +c FORTRAN read statements +c first get the header records and search for key parameters +100 irec = 1 +101 read (unit=nfobs,rec=irec,err=1002,iostat=ierr) head + call obshead (head,iend,line) + if (lount .eq. -1) return + if (iend .eq. 0) then + irec = irec + 1 + go to 101 + endif + + +c next read the flux array from the file + nrec = lount/nblock + ipt = 0 + if (mod(lount,nblock) .ne. 0) nrec = nrec + 1 + do j=1,nrec + irec = irec + 1 + jpt = min0(nblock,lount-ipt) + if (ibits .eq. 16) then + read (unit=nfobs,rec=irec,err=1006,iostat=ierr) int1 + if (byteswap .eq. 1) then + do k=2,2880,2 + onebyte = int1(k) + int1(k) = int1(k-1) + int1(k-1) = onebyte + enddo + endif + do k=1,jpt + yobs(ipt+k) = bzero + bscale*real(int2(k)) + enddo + elseif (ibits .eq. 32) then + read (unit=nfobs,rec=irec,err=1006,iostat=ierr) int1 + if (byteswap .eq. 1) then + do k=4,2880,4 + onebyte = int1(k) + int1(k) = int1(k-3) + int1(k-3) = onebyte + onebyte = int1(k-1) + int1(k-1) = int1(k-2) + int1(k-2) = onebyte + enddo + endif + do k=1,jpt + yobs(ipt+k) = bzero + bscale*real(int4(k)) + enddo + elseif(ibits .eq. -32) then + read (unit=nfobs,rec=irec,err=1006,iostat=ierr) int1 + if (byteswap .eq. 1) then + do k=4,2880,4 + onebyte = int1(k) + int1(k) = int1(k-3) + int1(k-3) = onebyte + onebyte = int1(k-1) + int1(k-1) = int1(k-2) + int1(k-2) = onebyte + enddo + endif + do k=1,jpt + yobs(ipt+k) = real4(k) + enddo + endif + ipt = ipt + jpt + enddo + + +c now adjust the continuum, if desired + do j=1,lount + yobs(j) = yobs(j)*contnorm + enddo + + +c now fill in the wavelength array + do j=1,lount + xobs(j) = sngl(wavecalc(sngl(dfloat(j)),lount,disp)) + enddo + lim1obs = 1 + lim2obs = lount + if(xobs(2) .lt. xobs(1)) then + do j=1,lount/2 + xtemp = xobs(j) + ytemp = yobs(j) + xobs(j) = xobs(lount+1-j) + yobs(j) = yobs(lount+1-j) + xobs(lount+1-j) = xtemp + yobs(lount+1-j) = ytemp + enddo + endif + return + + +c or if trouble, give error messages, and abort +1002 write(array,1003) ierr + istat = ivwrite(line+2,3,array,39) + go to 1007 +1006 write(array,1004) ierr + istat = ivwrite(line+2,3,array,39) +1007 lount = -1 + return + + +c*****this is a dummy for future file use +200 return + + +c*****this is a dummy for future file use +300 return + + +c*****this is a dummy for future file use +400 return + + +c*****here is a MONGO-style input array +500 rewind nfobs + read (nfobs,5001) obsitle + i = 1 +501 read (nfobs,*,end=525) xobs(i),yobs(i) + i = i + 1 + go to 501 +525 lount = i - 1 + lim1obs = 1 + lim2obs = lount + if(xobs(2) .lt. xobs(1)) then + do j=1,lount/2 + xtemp = xobs(j) + ytemp = yobs(j) + xobs(j) = xobs(lount+1-j) + yobs(j) = yobs(lount+1-j) + xobs(lount+1-j) = xtemp + yobs(lount+1-j) = ytemp + enddo + endif + + +c now adjust the continuum, if desired + do j=1,lount + yobs(j) = yobs(j)*contnorm + enddo + return + + +c*****format statements +1003 format('ERROR IN FITS HEADER READ: ERROR=',i4) +1004 format('ERROR IN DATA READ: ERROR=',i4,'/') +1021 format (80(' ')) +5001 format (a80) + + + end + + + diff --git a/Rinteg.f b/Rinteg.f new file mode 100755 index 0000000..3534613 --- /dev/null +++ b/Rinteg.f @@ -0,0 +1,66 @@ + + real*8 function rinteg(x,f,fint,n,start) +c****************************************************************************** +c This routine is from ATLAS6 +c****************************************************************************** + + implicit real*8 (a-h,o-z) + real*8 x(5000), f(5000), fint(5000) + real*8 a(5000), b(5000), c(5000) + + call parcoe (f,x,a,b,c,n) + fint(1) = start + rinteg = start + n1 = n - 1 + do 10 i=1,n1 + fint(i+1)= (a(i)+b(i)/2.*(x(i+1)+x(i))+ + . c(i)/3.*((x(i+1)+x(i))*x(i+1)+x(i)*x(i)))*(x(i+1)-x(i)) +10 rinteg = rinteg + fint(i+1) + + return + end + + + + + subroutine parcoe(f,x,a,b,c,n) + + implicit real*8 (a-h,o-z) + real*8 f(5000), x(5000), a(5000), b(5000), c(5000) + + c(1)=0. + b(1)=(f(2)-f(1))/(x(2)-x(1)) + a(1)=f(1)-x(1)*b(1) + n1=n-1 + c(n)=0. + b(n)=(f(n)-f(n1))/(x(n)-x(n1)) + a(n)=f(n)-x(n)*b(n) + if(n.eq.2)return + do 1 j=2,n1 + j1=j-1 + d=(f(j)-f(j1))/(x(j)-x(j1)) + c(j)=f(j+1)/((x(j+1)-x(j))*(x(j+1)-x(j1)))-f(j)/((x(j)-x(j1))* + 1(x(j+1)-x(j)))+f(j1)/((x(j)-x(j1))*(x(j+1)-x(j1))) + b(j)=d-(x(j)+x(j1))*c(j) + 1 a(j)=f(j1)-x(j1)*d+x(j)*x(j1)*c(j) + c(2)=0. + b(2)=(f(3)-f(2))/(x(3)-x(2)) + a(2)=f(2)-x(2)*b(2) + c(3)=0. + b(3)=(f(4)-f(3))/(x(4)-x(3)) + a(3)=f(3)-x(3)*b(3) + if(c(j).eq.0.)go to 2 + j1=j+1 + wt=abs(c(j1))/(abs(c(j1))+abs(c(j))) + a(j)=a(j1)+wt*(a(j)-a(j1)) + b(j)=b(j1)+wt*(b(j)-b(j1)) + c(j)=c(j1)+wt*(c(j)-c(j1)) + 2 continue + a(n1)=a(n) + b(n1)=b(n) + c(n1)=c(n) + return + end + + + diff --git a/Setmols.f b/Setmols.f new file mode 100755 index 0000000..14639c5 --- /dev/null +++ b/Setmols.f @@ -0,0 +1,99 @@ + + subroutine setmols +c****************************************************************************** +c This subroutine is invoked at the end of each call to *eqlib*: +c it transfers some of the output number densities to arrays needed +c for opacities, etc. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Mol.com' + include 'Dummy.com' + integer nel(7) + integer append + data (nel(i),i=1,7)/ 1, 2, 6, 12, 13, 14, 26/ + + +c In the number density array "numdens", the elements denoted by +c the first subscripts are named in at the ends of the assignment +c lines; at present these are the only ones needed for continuous +c opacities +c the desired elements are H, He, C, Mg, Al, Si, Fe, along +c with the H_2 molecule +c first do the neutrals + do j=1,7 + do k=1,neq + if (nel(j) .eq. iorder(k)) then + do i=1,ntau + numdens(j,1,i) = xamol(k,i) + enddo + exit + endif + enddo + enddo + + +c*****then do the ions + do j=1,7 + ispec10 = nint(dble(10*nel(j)+1)) + do k=1,nmol + kmol10 = nint(10.*amol(k)) + if (ispec10 .eq. kmol10) then + do i=1,ntau + numdens(j,2,i) = xmol(k,i) + enddo + exit + endif + enddo + enddo + + +c*****finally add in H_2 + do k=1,nmol + ispec = 101 + if (ispec .eq. nint(amol(k))) then + do i=1,ntau + numdens(8,1,i) = xmol(k,i) + enddo + exit + endif + enddo + + +c*****compute partitiion functions for H_2O and CO_2; + do i=1,ntau + h2olog = 0. + co2log = 0. + if (t(i) .gt. 5000.) then + uh2o(i) = 1.d8 + uco2(i) = 1.d8 + else + do j=1,5 + h2olog = h2olog + h2ocoeff(j)*t(i)**(j-1) + co2log = co2log + co2coeff(j)*t(i)**(j-1) + enddo + uh2o(i) = 10**h2olog + uco2(i) = 10**co2log + endif + enddo + + +c*****transfer H_2O and CO_2 number densities from the molecular +c equilibrium output +c note: HITRAN partition functions are given only for T < 5000K + do j=1,nmol + if (nint(amol(j)) .eq. 10108) ih2o = j + if (nint(amol(j)) .eq. 60808) ico2 = j + enddo + do i=1,ntau + xnh2o(i) = xmol(ih2o,i) + xnco2(i) = xmol(ico2,i) + enddo + + +c*****yes, perhaps not the most efficient coding, but it works - I hope + return + + end + diff --git a/Setmols.r b/Setmols.r new file mode 100755 index 0000000..149ba41 --- /dev/null +++ b/Setmols.r @@ -0,0 +1,513 @@ + + subroutine inmodel +c****************************************************************************** +c This subroutine reads in the model +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Mol.com' + include 'Quants.com' + include 'Factor.com' + include 'Dummy.com' + include 'Pstuff.com' + real*8 element(95), logepsilon(95) + real*8 kaprefmass(100) + real*8 bmol(110) + integer nel(7) + character list*80, list2*70 + integer append + data (nel(i),i=1,7)/ 1, 2, 6, 12, 13, 14, 26/ + + +c*****Read in the key word to define the model type + modelnum = modelnum + 1 + rewind nfmodel + read (nfmodel,2001) modtype + write (nf1out,1010) modtype + if (modtype .eq. 'begn ' .or. modtype .eq. 'BEGN ') + . write (nf1out,1011) + + +c*****Read a comment line (usually describing the model) + read (nfmodel,2002) moditle + + +c*****Read the number of depth points + read (nfmodel,2002) list + list2 = list(11:) + read (list2,*) ntau + if (ntau .gt. 100) then + write (array,1012) + call prinfo (10) + stop + endif + + +c*****EITHER: Read in a model from the output of the experimental new +c MARCS code. This modtype is called "NEWMARCS". On each line +c the numbers are: +c tau(5000), t, pe, pgas, rho, model microtrubulent velocity, +c and mean opacity (cm^2/gm) at the reference wavelength (5000A). + if (modtype .eq. 'NEWMARCS ') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),ne(i),pgas(i),rho(i), + . vturb(1),kaprefmass(i) + enddo +c*****OR: Read in a model from the output of the on-line new +c MARCS code. This modtype is called "WEBMARCS". On each line +c the numbers are: +c layer number (not needed), log{tau(Rosseland)} (not needed), +c log{tau(5000)}, depth, t, pe, pgas, prad (not read in) and +c pturb (not read in) + elseif (modtype .eq. 'WEBMARCS') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) k, dummy1(k), tauref(i), dummy2(k), t(i), + . ne(i), pgas(i) + enddo +c*****OR: Read in a model from an alternative form of on-line new +c MARCS code. This modtype is called "WEB2MARC". On each line +c the numbers are: +c atmospheric layer number (not needed), log{tau(5000)}, t, +c log(Pe), log(Pgas), rhox + elseif (modtype .eq. 'WEB2MARC') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) k,tauref(i),t(i),ne(i),pgas(i),rhox(i) + enddo +c OR: Read in a model from the output of the ATLAS code. This +c modtype is called "KURUCZ". On each line the numbers are: +c rhox, t, pgas, ne, and Rosseland mean opacity (cm^2/gm), and +c two numbers not used by MOOG. + elseif (modtype .eq. 'KURUCZ ') then + do i=1,ntau + read (nfmodel,*) rhox(i),t(i),pgas(i),ne(i),kaprefmass(i) + enddo +c OR: Read in a model from the output of the NEXTGEN code. This +c modtype is called "NEXTGEN". These models have tau scaled at a +c specific wavelength that is read in before the model. MOOG will +c need to generate the opacities internally.On each line the numbers +c are: tau, t, pgas, pe, density, mean molecular weight, two numbers +c not used by MOOG, and Rosseland mean opacity (cm^2/gm). + elseif (modtype .eq. 'NEXTGEN ') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),pgas(i),ne(i), rho(i), + . molweight(i), x2, x3, kaprefmass(i) + enddo +c OR: Read in a model from the output of the MARCS code. This modtype +c type is called "BEGN". On each line the numbers are: +c tauross, t, log(pg), log(pe), mol weight, and kappaross. + elseif (modtype .eq. 'BEGN ') then + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),pgas(i),ne(i), + . molweight(i), kaprefmass(i) + enddo +c OR: Read in a model generated from ATLAS, but without accompanying +c opacities. MOOG will need to generate the opacities internally, +c using a reference wavelength that it reads in before the model. + elseif (modtype .eq. 'KURTYPE') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) rhox(i),t(i),pgas(i),ne(i) + enddo +c OR: Read in a model generated from ATLAS, with output generated +c in Padova. The columns are in somewhat different order than normal + elseif (modtype .eq. 'KUR-PADOVA') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),kaprefmass(i), + . ne(i),pgas(i),rho(i) + enddo +c OR: Read in a generic model that has a tau scale at a specific +c wavelength that is read in before the model. +c MOOG will need to generate the opacities internally. + elseif (modtype .eq. 'GENERIC ') then + read (nfmodel,*) wavref + do i=1,ntau + read (nfmodel,*) tauref(i),t(i),pgas(i),ne(i) + enddo +c OR: quit in utter confusion if those model types are not specified + else + write (*,1001) + stop + endif + + +c*****Compute other convenient forms of the temperatures + do i=1,ntau + theta(i) = 5040./t(i) + tkev(i) = 8.6171d-5*t(i) + tlog(i) = dlog(t(i)) + enddo + + +c*****Convert from logarithmic Pgas scales, if needed + if (pgas(ntau)/pgas(1) .lt. 10.) then + do i=1,ntau + pgas(i) = 10.0**pgas(i) + enddo + endif + + +c*****Convert from logarithmic Ne scales, if needed + if(ne(ntau)/ne(1) .lt. 20.) then + do i=1,ntau + ne(i) = 10.0**ne(i) + enddo + endif + + +c*****Convert from Pe to Ne, if needed + if(ne(ntau) .lt. 1.0e7) then + do i=1,ntau + ne(i) = ne(i)/1.38054d-16/t(i) + enddo + endif + + +c*****compute the atomic partition functions + do j=1,95 + elem(j) = dble(j) + call partfn (elem(j),j) + enddo + + +c*****Read the microturbulence (either a single value to apply to +c all layers, or a value for each of the ntau layers). +c Conversion to cm/sec from km/sec is done if needed + read (nfmodel,2003) (vturb(i),i=1,6) + if (vturb(2) .ne. 0.) then + read (nfmodel,2003) (vturb(i),i=7,ntau) + else + do i=2,ntau + vturb(i) = vturb(1) + enddo + endif + if (vturb(1) .lt. 100.) then + write (moditle(55:62),1008) vturb(1) + do i=1,ntau + vturb(i) = 1.0e5*vturb(i) + enddo + else + write (moditle(55:62),1008) vturb(1)/1.0e5 + endif + + +c*****Read in the abundance data, storing the original abundances in xabu +c*****The abundances not read in explicity are taken from the default +c*****solar ones contained in array xsolar. + read (nfmodel,2002) list + list2 = list(11:) + read (list2,*) natoms,abscale + write (moditle(63:73),1009) abscale + if(natoms .ne. 0) + . read (nfmodel,*) (element(i),logepsilon(i),i=1,natoms) + xhyd = 10.0**xsolar(1) + xabund(1) = 1.0 + xabund(2) = 10.0**xsolar(2)/xhyd + do i=3,95 + xabund(i) = 10.0**(xsolar(i)+abscale)/xhyd + xabu(i) = xabund(i) + enddo + if (natoms .ne. 0) then + do i=1,natoms + xabund(idint(element(i))) = 10.0**logepsilon(i)/xhyd + xabu(idint(element(i))) = 10.0**logepsilon(i)/xhyd + enddo + endif + +c*****Compute the mean molecular weight, ignoring molecule formation +c in this approximation (maybe make more general some day?) + wtnum = 0. + wtden = 0. + do i=1,95 + wtnum = wtnum + xabund(i)*xam(i) + wtden = wtden + xabund(i) + enddo + wtmol = wtnum/(xam(1)*wtden) + nomolweight = 0 + if (modtype .eq. 'BEGN ' .or. modtype .eq. 'NEXTGEN ') then + nomolweight = 1 + endif + if (nomolweight .ne. 1) then + do i=1,ntau + molweight(i) = wtmol + enddo + endif + +c*****Compute the density + if (modtype .ne. 'NEXTGEN ') then + do i=1,ntau + rho(i) = pgas(i)*molweight(i)*1.6606d-24/(1.38054d-16*t(i)) + enddo + endif + + +c*****Calculate the fictitious number density of hydrogen +c Note: ph = (-b1 + dsqrt(b1*b1 - 4.0*a1*c1))/(2.0*a1) + iatom = 1 + call partfn (dble(iatom),iatom) + do i=1,ntau + th = 5040.0/t(i) + ah2 = 10.0**(-(12.7422+(-5.1137+(0.1145-0.0091*th)*th)*th)) + a1 = (1.0+2.0*xabund(2))*ah2 + b1 = 1.0 + xabund(2) + c1 = -pgas(i) + ph = (-b1/2.0/a1)+dsqrt((b1**2/(4.0*a1*a1))-(c1/a1)) + nhtot(i) = (ph+2.0*ph*ph*ah2)/(1.38054d-16*t(i)) + enddo + + +c*****Molecular equilibrium called here. +c First, a default list of ions and molecules is considered. Then the +c user's list is read in. A check is performed to see if any of these +c species need to be added. If so, then they are appended to the +c default list. The molecular equilibrium routine is then called. +c Certain species are important for continuous opacities and damping +c calculations - these are read from the equilibrium solution and +c saved. + + +c*****Set up the default molecule list + if (molset .eq. 0) then + nmol = 30 + else + nmol = 59 + endif + if (molset .eq. 0) then + do i=1,110 + amol(i) = smallmollist(i) + enddo + elseif (molset .eq. 1) then + do i=1,110 + amol(i) = largemollist(i) + enddo + else + array = 'molset = 0 or 1 only; I quit!' + call putasci (29,6) + stop + endif + + +c*****Read in the names of additional molecules to be used in +c molecular equilibrium if needed. + read (nfmodel,2002,end=101) list + list2 = list(11:) + read (list2,*) moremol + if (moremol .ne. 0) then + read (nfmodel,*) (bmol(i),i=1,moremol) + append = 1 + do k=1,moremol + do l=1,nmol + if (nint(bmol(k)) .eq. nint(amol(l))) + . append = 0 + enddo + if (append .eq. 1) then + nmol = nmol + 1 + amol(nmol) = bmol(k) + endif + append = 1 + enddo + endif + + +c*****do the general molecular equilibrium +101 call eqlib + call resetmol + + +c In the number density array "numdens", the elements denoted by +c the first subscripts are named in at the ends of the assignment +c lines; at present these are the only ones needed for continuous +c opacities +c the desired elements are H, He, C, Mg, Al, Si, Fe, along +c with the H_2 molecule +c first do the neutrals + do j=1,7 + do k=1,neq + if (nel(j) .eq. iorder(k)) then + do i=1,ntau + numdens(j,1,i) = xamol(k,i) + enddo + exit + endif + enddo + enddo +c then do the ions + do j=1,7 + ispec10 = nint(dble(10*nel(j)+1)) + do k=1,nmol + kmol10 = nint(10.*amol(k)) + if (ispec10 .eq. kmol10) then + do i=1,ntau + numdens(j,2,i) = xmol(k,i) + enddo + exit + endif + enddo + enddo +c finally add in H_2 + do k=1,nmol + ispec = 101 + if (ispec .eq. nint(amol(k))) then + do i=1,ntau + numdens(8,1,i) = xmol(k,i) + enddo + exit + endif + enddo + + +c*****compute partitiion functions for H_2O and CO_2; + do i=1,ntau + h2olog = 0. + co2log = 0. + if (t(i) .gt. 5000.) then + uh2o(i) = 1.d8 + uco2(i) = 1.d8 + else + do j=1,5 + h2olog = h2olog + h2ocoeff(j)*t(i)**(j-1) + co2log = co2log + co2coeff(j)*t(i)**(j-1) + enddo + uh2o(i) = 10**h2olog + uco2(i) = 10**co2log + endif + enddo + + +c*****transfer H_2O and CO_2 number densities from the molecular +c equilibrium output +c note: HITRAN partition functions are given only for T < 5000K + do j=1,nmol + if (nint(amol(j)) .eq. 10108) ih2o = j + if (nint(amol(j)) .eq. 60808) ico2 = j + enddo + do i=1,ntau + xnh2o(i) = xmol(ih2o,i) + xnco2(i) = xmol(ico2,i) + enddo + + +c*****SPECIAL NEEDS: for NEWMARCS models, to convert kaprefs to our units + if (modtype .eq. 'NEWMARCS ') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for KURUCZ models, to create the optical depth array, +c and to convert kaprefs to our units + elseif (modtype .eq. 'KURUCZ ') then + first = rhox(1)*kaprefmass(1) + tottau = rinteg(rhox,kaprefmass,tauref,ntau,first) + tauref(1) = first + do i=2,ntau + tauref(i) = tauref(i-1) + tauref(i) + enddo + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for NEXTGEN models, to convert kaprefs to our units + elseif (modtype .eq. 'NEXTGEN ') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for BEGN models, to convert kaprefs to our units + elseif (modtype .eq. 'BEGN ') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for KURTYPE models, to create internal kaprefs, +c and to compute taurefs from the kaprefs converted to mass units + elseif (modtype .eq. 'KURTYPE ') then + call opacit (1,wavref) + do i=1,ntau + kaprefmass(i) = kapref(i)/rho(i) + enddo + first = rhox(1)*kaprefmass(1) + tottau = rinteg(rhox,kaprefmass,tauref,ntau,first) + tauref(1) = first + do i=2,ntau + tauref(i) = tauref(i-1) + tauref(i) + enddo +c SPECIAL NEEDS: for NEWMARCS models, to convert kaprefs to our units + elseif (modtype .eq. 'KUR-PADOVA') then + do i=1,ntau + kapref(i) = kaprefmass(i)*rho(i) + enddo +c SPECIAL NEEDS: for generic models, to create internal kaprefs, + elseif (modtype .eq. 'GENERIC ' .or. + . modtype .eq. 'WEBMARCS ' .or. + . modtype .eq. 'WEB2MARC ') then + call opacit (1,wavref) + endif + + +c*****Convert from logarithmic optical depth scales, or vice versa. +c xref will contain the log of the tauref + if(tauref(1) .lt. 0.) then + do i=1,ntau + xref(i) = tauref(i) + tauref(i) = 10.0**xref(i) + enddo + else + do i=1,ntau + xref(i) = dlog10(tauref(i)) + enddo + endif + + +c*****Write information to output files + if (modprintopt .lt. 1) return + write (nf1out,1002) moditle + do i=1,ntau + dummy1(i) = dlog10(pgas(i)) + dummy2(i) = dlog10(ne(i)*1.38054d-16*t(i)) + enddo + write (nf1out,1003) wavref,(i,xref(i),tauref(i),t(i),dummy1(i), + . pgas(i),dummy2(i),ne(i),vturb(i),i=1,ntau) + write (nf1out,1004) + do i=1,95 + dummy1(i) = dlog10(xabund(i)) + 12.0 + enddo + write (nf1out,1005) (names(i),i,dummy1(i),i=1,95) + write (nf1out,1006) modprintopt, molopt, linprintopt, fluxintopt + write (nf1out,1007) (kapref(i),i=1,ntau) + return + + +c*****format statements +2001 format (a10) +2002 format (a80) +2003 format (6d13.0) +1001 format('permitted model types are:'/'KURUCZ, BEGN, ', + . 'KURTYPE, KUR-PADOVA, NEWMARCS, WEBMARCS, NEXTGEN, ', + . 'WEB2MARC, or GENERIC'/ 'MOOG quits!') +1002 format (/'MODEL ATMOSPHERE HEADER:'/a80/) +1003 format ('INPUT ATMOSPHERE QUANTITIES', 10x, + . '(reference wavelength =',f10.2,')'/3x, 'i', 2x, 'xref', + . 3x, 'tauref', 7x, 'T', 6x, 'logPg', 4x, 'Pgas', + . 6x, 'logPe', 5x, 'Ne', 9x, 'Vturb'/ + . (i4, 0pf6.2, 1pd11.4, 0pf9.1, f8.3, 1pd11.4, 0pf8.3, + . 1pd11.4, d11.2)) +1004 format (/'INPUT ABUNDANCES: (log10 number densities, log H=12)'/ + . ' Default solar abundances: Asplund et al. 2009') +1005 format (5(3x,a2, '(',i2,')=', f5.2)) +1006 format (/'OPTIONS: atmosphere = ', i1, 5x, 'molecules = ', i1/ + . ' lines = ', i1, 5x, 'flux/int = ', i1) +1007 format (/'KAPREF ARRAY:'/(6(1pd12.4))) +1008 format ('vt=', f5.2) +1009 format (' M/H=', f5.2) +1010 format (13('-'),'MOOG OUTPUT FILE', 10('-'), + . '(MOOG version from 01/28/09)', 13('-')// + . 'THE MODEL TYPE: ', a10) +1011 format (' The Rosseland opacities and optical depths have ', + . 'been read in') +1012 format ('HOUSTON, WE HAVE MORE THAN 100 DEPTH POINTS! I QUIT!') + + + end + diff --git a/Smooth.f b/Smooth.f new file mode 100755 index 0000000..4acd92b --- /dev/null +++ b/Smooth.f @@ -0,0 +1,523 @@ + + subroutine smooth (line,ncall) +c****************************************************************************** +c This subroutine prepares synthesis data for plotting by smoothing +c the data in various ways. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Equivs.com' + real*4 shortnum + character*5 abchars + character*4 isochars + + +c*****initialize parameters + write (abitle(1:400),1081) + write (isoitle(1:240),1082) + nsyn = 1 + if (ncall .eq. 1) then + gaussflag = 'f' + rotateflag = 'f' + lorenflag = 'f' + macroflag = 'f' + if (choice .ne. 'l') addflux = 0. + endif + + +c*****on entering, figure out what kind of smoothing is desired, unless +c the default smoothing options have been set for first pass + if (line .gt. 0) then +2 write (array,1007) + istat = ivwrite (line,3,array,67) + write (array,1004) + istat = ivwrite (line+1,3,array,50) + array = 'What is your choice? ' + nchars = 21 + call getasci (nchars,line+2) + smtype = chinfo(1:1) + if (smtype.ne.'n' .and. smtype.ne.'g' .and. + . smtype.ne.'l' .and. smtype.ne.'v' .and. + . smtype.ne.'m' .and. smtype.ne.'c' .and. + . smtype.ne.'d' .and. smtype.ne.'r' .and. + . smtype.ne.'p') go to 2 + endif + + +c if a user-specified variable Gaussian smoothing over the spectral range +c is called for, option 'p', branch to a different routine + if (smtype .eq. 'p') then + call vargauss (line+1) + return + endif + + +c*****rewind the unsmoothed and smoothed spectrum output +c files, and get the synthesis range parameters from the 'dump' file + rewind nf2out + rewind nf3out + do i=1,20 + read (nf2out,1002) array + if (array(1:7).eq.'element' .or. + . array(1:7).eq.'Changin' .or. + . array(1:7).eq.'ALL abu' .or. + . array(1:7).eq.'Isotopi') then + cycle + elseif (array(1:7).eq.'MODEL: ') then + moditle(1:73) = array(8:80) + read (nf2out,*) start, sstop, step + kount = int((sstop - start + (step/4.0) )/step) + 1 + exit + endif + enddo + + +c*****branch to the desired smoothing function + write (smitle,1010) smtype + ism = 11 + if (smtype .eq. 'l') then + lorenflag = 't' + elseif (smtype .eq. 'g') then + gaussflag = 't' + elseif (smtype .eq. 'v') then + rotateflag = 't' + elseif (smtype .eq. 'c') then + rotateflag = 't' + gaussflag = 't' + elseif (smtype .eq. 'm') then + macroflag = 't' + elseif (smtype .eq. 'd') then + macroflag = 't' + gaussflag = 't' + elseif (smtype .eq. 'r') then + macroflag = 't' + rotateflag = 't' + gaussflag = 't' + endif + + +c*****compute a stellar rotational broadening function; this follows +c D. F. Gray, 1976, "The Obs. & Anal. of Stell. Phot", p394-9 + if (rotateflag .eq. 't') then +32 array = 'GIVE THE STELLAR vsini [0.0]: ' + nchars = 30 + if (line .gt. 0) then + call getnum (nchars,line+2,vsini,shortnum) + if (vsini .eq. -9999.) vsini = 0. + endif + if (vsini .lt. 0.0) go to 32 + write (smitle(ism+1:ism+13),1011) vsini + ism = ism + 13 +31 array = 'GIVE THE LIMB DARKENING COEFFICIENT [0.0]: ' + nchars = 43 + if (line .gt. 0) then + call getnum (nchars,line+2,limbdark,shortnum) + if (limbdark .eq. -9999.) limbdark = 0. + endif + if (limbdark .lt. 0.0) go to 31 + write (smitle(ism+1:ism+13),1012) limbdark + ism = ism + 13 + dlamlim = (start+sstop)/2.*vsini/3.0e5 + if (step .ge. dlamlim) then + rotateflag = 'f' + else + pi = 3.141527 + bottom = dlamlim*pi*(1.-limbdark/3.) + c1 = 2.*(1.-limbdark)/bottom + c2 = 0.5*limbdark*pi/bottom + prot0 = c1 + c2 + powerrot = prot0 + jdelrot = idint(dlamlim/step) + if (jdelrot .gt. 1000) then + write (*,1026) + smtype = 'e' + return + elseif (jdelrot .gt. kount/4) then + write (*,1028) + smtype = 'e' + return + endif + do i=1,jdelrot + dlam = (i-1)*step + term = 1. - (dlam/dlamlim)**2 + prot(i) = c1*dsqrt(term) + c2*term + powerrot = powerrot + 2.0*prot(i) + enddo + endif + endif + + +c*****compute a macroturbulent smoothing function (uses subroutine vmacro) + if (macroflag .eq. 't') then +51 array = 'GIVE THE MACROTURBULENT VELOCITY [0.0]: ' + nchars = 39 + if (line .gt. 0) then + call getnum (nchars,line+2,vmac,shortnum) + if (vmac .eq. -9999.) vmac = 0. + endif + if (vmac .lt. 0.0) go to 51 + write (smitle(ism+1:ism+13),1013) vmac + ism = ism + 13 + if (vmac .eq. 0.) then + macroflag = 'f' + else + wavemac = (start+sstop)/2.*vmac/3.0e5 + powermac = 1.0 + do i=1,1000 + wavei = step*i/wavemac + pmac(i) = vmacro(wavei) + powermac = powermac + 2.0 *pmac(i) + if (pmac(i) .lt. 0.002) then + jdelmac = i + exit + endif + enddo + if (jdelmac .gt. 1000) then + write (*,1025) wavemac + smtype = 'e' + return + elseif (jdelmac .gt. kount/4) then + write (*,1022) + smtype = 'e' + return + endif + endif + endif + + +c*****compute a Gaussian smoothing function + if (gaussflag .eq. 't') then +11 array = 'GIVE THE FWHM OF THE GAUSSIAN FUNCTION [0.0]: ' + nchars = 46 + if (line .gt. 0) then + call getnum (nchars,line+2,fwhmgauss,shortnum) + if (fwhmgauss .eq. -9999.) fwhmgauss = 0. + endif + if (fwhmgauss .lt. 0.0) go to 11 + write (smitle(ism+1:ism+18),1014) fwhmgauss + ism = ism + 18 + if (fwhmgauss .eq. 0.) then + gaussflag = 'f' + else + sigma = fwhmgauss/2. + aa = 0.6932/sigma**2 + power = 1.0 + do i=1,1000 + p(i) = dexp(-aa*(step*i)**2 ) + power = power + 2*p(i) + if (p(i) .lt. 0.02) then + jdel = i + exit + endif + enddo + if (jdel .gt. 1000) then + write (*,1029) sigma + smtype = 'e' + return + elseif (jdel .gt. kount/4) then + write (*,1021) + smtype = 'e' + return + endif + endif + endif + + +c*****compute a Lorenzian smoothing function + if (lorenflag .eq. 't') then +21 array = 'GIVE THE FWHM OF THE LORENTZIAN FUNCTION [0.0]: ' + nchars = 48 + if (line .gt. 0) then + call getnum (nchars,line+2,fwhmloren,shortnum) + if (fwhmloren .eq. -9999.) fwhmloren = 0. + endif + if (fwhmloren .lt. 0.0) go to 21 + write (smitle(ism+1:ism+20),1015) fwhmloren + ism = ism + 20 + if (fwhmloren .eq. 0.) then + lorenflag = 'f' + else + sigma = fwhmloren/2. + power = 1.0 + do i=1,1000 + p(i) = ((sigma**2)/((sigma**2)+((step*i)**2))) + power = power + 2.0 *p(i) + if (p(i) .lt. 0.02) then + jdel = i + exit + endif + enddo + if (jdel .gt. 1000) then + write (*,1030) sigma + smtype = 'e' + return + elseif (jdel .gt. kount/4) then + write (*,1031) + smtype = 'e' + return + endif + endif + endif + + +c*****finally there is a big loop that will read in the raw synthetic spectra, +c*****beginning with grabbing the information that appears before the array +c*****spectrum depth array, Note that after the depth array is input, the +c*****code will flip to a flux scale + rewind nf2out + do nsyn=1,100 + + +c*****here is the reading/grabbing of stuff preceding the depth array: + naboff = 80*(nsyn-1) + nabunds = 0 + nisos = 0 + do i=1,20 + read (nf2out,1002,end=2000) array + if (array(1:7).eq.'ALL abu') then + cycle + elseif (array(1:7).eq.'Changin') then + abitle (naboff+1:naboff+23) = '[M/H] FOR ALL ELEMENTS:' + abitle (naboff+24:naboff+29) = array(32:37) + cycle + elseif (array(1:7).eq.'element') then + nabunds = nabunds + 1 + if (control .eq. 'binary ') then + if (nabunds .le. 5) then + ioff = naboff + 16*(nabunds-1) + abitle(ioff+1:ioff+2) = array(9:10) + abitle(ioff+3:ioff+14) = array(26:37) + abitle(ioff+15:ioff+16) = ' ' + endif + else + if (nabunds .le. 8) then + ioff = naboff + 9*(nabunds-1) + abitle(ioff+1:ioff+2) = array(9:10) + read (array(26:32),*) abnum + if (abnum .gt. 0) then + write (abchars,1061) abnum + elseif (abnum .le. -10.) then + write (abchars,1062) abnum + else + write (abchars,1063) abnum + endif + abitle(ioff+3:ioff+7) = abchars + abitle(ioff+8:ioff+9) = ' ' + endif + endif + cycle + elseif (array(1:7).eq.'Isotopi') then + nisos = nisos + 1 + if (nisos .le. 6) then + read (array(37:46),1050) ratio + if (ratio .ge. 1000.) then + write (isochars,1054) int(ratio) + elseif (ratio .ge. 100.) then + write (isochars,1051) ratio + elseif (ratio .ge. 10.) then + write (isochars,1052) ratio + else + write (isochars,1053) ratio + endif + if (nsyn .eq. 1) then + ioff = 40*(nisos-1) + 5*(nsyn-1) + isoitle(ioff+1:ioff+10) = array(23:32) + isoitle(ioff+11:ioff+12) = ': ' + isoitle(ioff+13:ioff+16) = isochars(1:4) + isoitle(ioff+17:ioff+17) = '/' + else + ioff = 12 + 40*(nisos-1) + 5*(nsyn-1) + isoitle(ioff+1:ioff+4) = isochars(1:4) + isoitle(ioff+5:ioff+5) = '/' + endif + endif + elseif (array(1:7).eq.'MODEL: ') then + read (nf2out,1002) array + exit + endif + enddo + + +c*****here is the actual reading of the depth array + read (nf2out,1003,end=2000) (y(i),i=1,kount) + do i=1,kount + y(i) = 1.0 - y(i) + enddo + + +c*****here a veiling addition can be added in + if (addflux .gt. 0.0) then + do i=1,kount + y(i) = (y(i) + addflux)/(1.0+addflux) + enddo + endif + + +c*****apply the rotational broadening if desired + if (rotateflag .eq. 't') then + min = jdelrot + 1 + max = kount - jdelrot + do i=1,jdelrot + z(i) = 1. + z(kount-i+1) = 1. + enddo + do i=min,max + z(i) = prot0*y(i) + do j=1,jdelrot + z(i) = z(i) + prot(j)*(y(i-j) + y(i+j)) + enddo + z(i) = z(i)/powerrot + enddo + do i=1,kount + y(i) = z(i) + enddo + endif + + +c*****apply the macroturbulent broadening if desired + if (macroflag .eq. 't') then + min = jdelmac + 1 + max = kount - jdelmac + do i=1,jdelmac + z(i) = 1. + z(kount-i+1) = 1. + enddo + do i=min,max + z(i) = y(i) + do j=1,jdelmac + z(i) = z(i) + pmac(j)*(y(i-j) + y(i+j)) + enddo + z(i) = z(i)/powermac + enddo + do i=1,kount + y(i) = z(i) + enddo + endif + + +c*****apply the Gaussian or Lorenzian smoothing if desired (this +c is an either/or situation; only one of these can apply. + if (gaussflag .eq. 't' .or. lorenflag .eq. 't') then + min = jdel + 1 + max = kount - jdel + do i=1,jdel + z(i) = 1. + z(kount-i+1) = 1. + enddo + do i=min,max + z(i) = y(i) + do j=1,jdel + z(i) = z(i) + p(j)*(y(i-j) + y(i+j)) + enddo + z(i) = z(i)/power + enddo + do i=1,kount + y(i) = z(i) + enddo + endif + + +c*****move the smoothed spectrum (or unsmoothed, if nothing has +c been done to the y-array) into the appropriate array + do i = 1,kount + chunk(i,nsyn) = y(i) + enddo + + +c*****compute the wavelength array; must be done for each synthetic +c spectrum because of the way the equivalences were set up + if (iunits .eq. 1) then + do i=1,kount + xsyn(i) = 1.d-4*(start + (i-1)*step) + enddo + else + do i=1,kount + xsyn(i) = start + (i-1)*step + enddo + endif + + +c*****dump the smoothed spectrum in a MONGO-style set of +c (wavelength,flux) point pairs + write (nf3out,1005) kount,start,sstop,step + if (xsyn(1) .le. 100.0) then + write (nf3out,1009) (xsyn(i),chunk(i,nsyn),i=1,kount) + else + write (nf3out,1008) (xsyn(i),chunk(i,nsyn),i=1,kount) + endif + enddo + + +c*****exit the routine normally +2000 nsyn = nsyn - 1 + return + + +c*****a problem has developed in user-specified parameter (like a Gaussian +c FWHM being too big); print out a warning and let user decide what +c to do next + + +c*****format statements +1002 format (a80) +1003 format (10f7.4) +1004 format (' c=v+g, d=m+g, r=m+v+g, p=VARIABLE GAUSS') +1005 format ('the number of points per synthesis = ',i5/ + . 'start = ',f10.3,5x,'stop = ',f10.3,5x,'step = ',f10.3) +1007 format ('SMOOTHING: n=NONE, g=GAUSS, l=LORENZ, ', + . 'v=ROTATION, m=MACROTURBULENCE') +1008 format (f10.3,' ',f10.5) +1009 format (f10.6,' ',f10.5) +1010 format ('smoothing=',a1,69x) +1011 format (' Vsini=',f5.1) +1012 format (' L.D.C.=',f4.2) +1013 format (' Vmacro=',f4.1) +1014 format (' FWHMgauss=',f6.3) +1015 format (' FWHMlorentz=',f6.3) +1021 format ('ERROR: GAUSSIAN PROFILE COVERS WHOLE ', + . 'SPECTRUM!'/ + . ' INCREASE SYNTHESIS LENGTH OR DECREASE ', + . 'STEP SIZE?') +1022 format ('ERROR: MACROTURBULENT PROFILE COVERS WHOLE ', + . 'SPECTRUM!'/ + . ' INCREASE SYNTHESIS LENGTH OR DECREASE ', + . 'STEP SIZE?') +1025 format ('ERROR: MACROTURBULENT PROFILE TOO BIG! ', + . '(WAVELENGTH WIDTH=',f6.2,')'/ + . ' INCREASE SPECTRUM STEP SIZE?') +1026 format ('ERROR: ROTATIONAL PROFILE TOO BIG!'/ + . ' INCREASE SPECTRUM STEP SIZE?') +1028 format ('ERROR: ROTATIONAL PROFILE COVERS WHOLE ', + . 'SPECTRUM!'/ + . ' INCREASE SYNTHESIS LENGTH OR DECREASE ', + . 'STEP SIZE?') +1029 format ('ERROR: GAUSSIAN PROFILE TOO BIG! ', + . '(HALF WIDTH=',f6.2,')'/ + . ' INCREASE SPECTRUM STEP SIZE?') +1030 format ('ERROR: LORENZIAN PROFILE TOO BIG! ', + . '(HALF WIDTH=',f6.2,')'/ + . ' INCREASE SPECTRUM STEP SIZE?') +1031 format ('ERROR: LORENZIAN PROFILE COVERS WHOLE ', + . 'SPECTRUM!'/ + . ' INCREASE SYNTHESIS LENGTH OR DECREASE ', + . 'STEP SIZE?') +1050 format (f10.3) +1051 format (f4.0) +1052 format (f4.1) +1053 format (f4.2) +1054 format (i4) +1061 format ('+', f4.2) +1062 format (f5.1) +1063 format (f5.2) +1081 format (400(' ')) +1082 format (240(' ')) + + end + + + + + diff --git a/Specplot.f b/Specplot.f new file mode 100755 index 0000000..4e8f026 --- /dev/null +++ b/Specplot.f @@ -0,0 +1,335 @@ + + subroutine specplot +c****************************************************************************** +c This routine produces MONGO plots of the syntheses. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Quants.com' + include 'Factor.com' + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Equivs.com' + include 'Multistar.com' + real*4 style(1) + real*4 yup,ydown + integer iflip + + +c*****for grid syntheses, dump out relevant information to a file + if (choice .eq. 'g') then + write (nf6out,3001) syncount + write (nf6out,3002) obsitle, moditle, linitle, smitle + endif + + +c*****begin with a default window + call sm_location (3500,31000,4000,30000) + call sm_window (1,1,1,1,1,1) + call sm_limits (0.0,1.0,0.0,1.0) + call defcolor (1) + + +c*****write smoothing information at the top of the plot + call sm_lweight (2.2) + call sm_expand (0.7) + call sm_relocate (-0.120,1.015) + call sm_label (smitle) + + + if (isoitle(1:10) .eq. ' ') then + isoitle(1:16) = 'no isotopic data' + endif + call sm_relocate (-0.120,1.075) + call sm_label (isoitle(1:120)) + if (numiso .gt. 3) then + call sm_relocate (-0.120,1.045) + call sm_label (isoitle(121:240)) + endif + if (control .eq. 'gridplo' .or. + . control .eq. 'gridsyn' .or. + . control .eq. 'gridend') then + write (nf6out,3002) isoitle(1:120) + write (nf6out,3002) isoitle(121:240) + endif + + +c*****define the real plot limits + if (xlo .lt. xhi) then + call sm_limits (xlo,xhi,ylo,yhi) + iflip = 0 + else + call sm_limits (xhi,xlo,ylo,yhi) + iflip = 1 + endif + call findtic (xlo,xhi,bigxtic,smlxtic) + call findtic (ylo,yhi,bigytic,smlytic) + call sm_ticksize (smlxtic,bigxtic,smlytic,bigytic) + + +c*****draw and label the box for the spectra + call defcolor (1) + if (whichwin .eq. '1of1') then + idev = 1 + call sm_window (1,1,1,1,1,1) + else + idev = 2 + call sm_defvar ('y_gutter','0.0') + call sm_window (1,2,1,1,1,1) + endif + call sm_lweight (4.0) + call sm_expand (1.2) + call sm_box (0,0,0,0) + call sm_lweight (2.0) + call sm_expand (0.8) + call sm_box (1,2,4,4) + if (iflip .eq. 1) then + array = 'Wavenumber' + else + array = 'Wavelength' + endif + call sm_xlabel (array) + array = 'Rel Flux' + call sm_ylabel (array) + + +c*****plot the synthetic spectra + call sm_lweight (2.2) + call sm_expand (0.7) + do i=1,100 + if (pec(i) .ne. 0) go to 111 + enddo +111 do j=1,nsyn + if (choice.eq.'h' .or. choice.eq.'f' .or. + . choice.eq.'g') then + call defcolor (8) + call sm_ltype (j-1) + else + if (smterm(1:3) .eq. 'x11') then + call defcolor (j+1) + call sm_ltype (0) + else + call defcolor (1) + call sm_ltype (j-1) + endif + endif + call sm_connect (xsyn,chunk(1,j),kount) + if (iflip .eq. 1) then + call sm_relocate (xhi+0.045*(xlo-xhi), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + call sm_draw (xhi+0.005*(xlo-xhi), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + call sm_relocate (xhi+0.05*(xlo-xhi), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + else + call sm_relocate (xlo+0.045*(xhi-xlo), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + call sm_draw (xlo+0.005*(xlo-xhi), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + call sm_relocate (xlo+0.05*(xhi-xlo), + . ylo+(0.12+0.06*j)*(yhi-ylo)) + endif + noff = 80*(j-1) + call sm_lweight (2.2) + call sm_label (abitle(noff+1:noff+80)) + if ((control .eq. 'gridplo' .or. + . control .eq. 'gridsyn' .or. + . control .eq. 'gridend') .and. + . whichwin.eq.'1of1') then + write (nf6out,3002) abitle(noff+1:noff+80) + endif + enddo + call defcolor (1) + call sm_ltype (0) + + +c*****plot the observed spectrum + if (plotopt .eq. 2) then + call defcolor (1) + if (choice.eq.'h' .or. choice.eq.'f' .or. + . choice.eq.'g') then + call sm_lweight (4.0) + else + call sm_lweight (2.2) + endif + call sm_ltype (0) + call sm_expand (3.0) + style(1) = 43.5 + call sm_ptype (style,1) + mount = lim2obs - lim1obs + 1 + if (mount .lt. 500) then + call sm_points (xobs(lim1obs),yobs(lim1obs),mount) + else + if (histoyes .eq. 1) then + call sm_histogram (xobs(lim1obs),yobs(lim1obs),mount) + else + call sm_connect (xobs(lim1obs),yobs(lim1obs),mount) + endif + endif + call sm_lweight (2.2) + call sm_expand (0.7) + if (iflip .eq. 1) then + call sm_relocate (xhi+0.05*(xlo-xhi),ylo+0.12*(yhi-ylo)) + else + call sm_relocate (xlo+0.05*(xhi-xlo),ylo+0.12*(yhi-ylo)) + endif + call sm_label (obsitle) + endif + if (iflip .eq. 1) then + call sm_relocate (xhi+0.05*(xlo-xhi),ylo+0.06*(yhi-ylo)) + else + call sm_relocate (xlo+0.05*(xhi-xlo),ylo+0.06*(yhi-ylo)) + endif + call sm_label (moditle) + if (whichwin.eq.'1of1' .or. plotopt.ne.2) then + return + endif + + +c*****this section of code is executed only if a deviations plot is desired; +c find the starting and stopping points in the arrays for the deviations + if (xsyn(kount) .le. xobs(lim1obs)) go to 1000 + if (xsyn(1) .gt. xobs(lim2obs)) go to 1000 + if (xsyn(1) .gt. xobs(lim1obs)) go to 150 + lim3obs = lim1obs + do k=2,kount + if (xsyn(k) .gt. xobs(lim3obs)) then + lim1syn = k - 1 + go to 155 + endif + enddo +150 lim1syn = 1 + do l=lim1obs,lim2obs + if (xsyn(lim1syn) .le. xobs(l)) then + lim3obs = l + go to 155 + endif + enddo +155 if (xsyn(kount) .lt. xobs(lim2obs)) go to 160 + lim4obs = lim2obs + do k=lim1syn,kount + if (xsyn(k) .gt. xobs(lim4obs)) then + lim2syn = k + go to 165 + endif + enddo +160 lim2syn = kount + do l=lim3obs,lim2obs + if (xsyn(lim2syn) .lt. xobs(l)) then + lim4obs = l - 1 + go to 165 + endif + enddo + + +c compute the deviations; linear interpolation in the wavelength array +c of the synthetic spectra is considered sufficient +165 open (222,file='devfile') + do j=1,nsyn + lpoint = lim1syn + devsigma = 0. + do i=lim3obs,lim4obs +170 if (xsyn(lpoint+1) .lt. xobs(i)) then + lpoint = lpoint + 1 + go to 170 + endif + syninterp = (chunk(lpoint+1,j)-chunk(lpoint,j))* + . (xobs(i)-xsyn(lpoint))/(xsyn(lpoint+1)-xsyn(lpoint)) + + . chunk(lpoint,j) + dev(i) = yobs(i) - syninterp + devsigma = devsigma + dev(i)**2 + enddo + devsigma = dsqrt(devsigma/(lim4obs-lim3obs-1)) + write (222,1222) j +1222 format ('deviation array ', i1) + write (222,1223) (xobs(i),dev(i),i=lim3obs,lim4obs) +1223 format (f10.3, f8.3) + + +c from first set of deviations, define the plot limits, draw and label box + if (j .eq. 1) then + yup = -1000. + ydown = +1000. + do i=lim3obs,lim4obs + yup = amax1(yup,dev(i)) + ydown = amin1(ydown,dev(i)) + enddo + ydelta = amin1(0.3,amax1(0.05,1.5*(yup-ydown)/2.)) + ydown = -ydelta + yup = ydelta + call sm_defvar ('y_gutter','0.0') + call sm_window (1,2,1,2,1,2) + call sm_limits (xlo,xhi,ydown,yup) + call findtic (ydown,yup,bigytic,smlytic) + call sm_ticksize (smlxtic,bigxtic,smlytic,bigytic) + call sm_lweight (4.0) + call sm_expand (1.2) + call defcolor (1) + call sm_box (0,0,0,0) + call sm_lweight (2.0) + call sm_expand (0.8) + call sm_box (4,2,4,4) + array = 'Obs - Comp' + call sm_ylabel (array) + call sm_relocate (xlo,0.0) + call sm_draw (xhi,0.0) + endif + + +c plot the array of deviations + if (choice.eq.'h' .or. choice.eq.'f' .or. + . choice.eq.'g') then + call defcolor (8) + call sm_ltype (j-1) + else + if (smterm(1:3) .eq. 'x11') then + call defcolor (j+1) + call sm_ltype (0) + else + call defcolor (1) + call sm_ltype (j-1) + endif + endif + call defcolor (j+1) + call sm_lweight (2.2) + call sm_connect (xobs(lim1obs),dev(lim1obs),mount) + write (array,1021) devsigma + call sm_relocate(xhi-0.2*(xhi-xlo), + . ydown+(0.10+0.06*j)*(yup-ydown)) + call sm_relocate(xhi-0.24*(xhi-xlo), + . ydown+(0.10+0.06*j)*(yup-ydown)) + call sm_draw(xhi-0.215*(xhi-xlo), + . ydown+(0.10+0.06*j)*(yup-ydown)) + call sm_label (array) + if (choice .eq. 'g') then + noff = 80*(j-1) + write (nf6out,3002) abitle(noff+1:noff+80) + write (nf6out,3003) devsigma, velsh + endif + enddo + close (unit=222) + + +c reset the spectrum plot boundaries before exiting + if(xlo .lt. xhi) then + call sm_limits (xlo,xhi,ylo,yhi) + iflip = 0 + else + call sm_limits (xhi,xlo,ylo,yhi) + iflip = 1 + endif +1000 return + + +c*****format statements +1021 format ('sigma =',f7.4) +3001 format (/'RUN NUMBER:', i4, 65('-')) +3002 format (a80) +3003 format ('sigma =',f8.5, ' lambda shift =',f7.3,' km/s') + + + end + + + @@ -0,0 +1,103 @@ + + subroutine stats +c****************************************************************************** +c This routine does abundance statistics for a single species +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + +c*****compute the average and standard deviation + average = 0. + kount = 0 + do l=lim1obs,lim2obs + if (abundout(l) .ne. 999.99) then + average = average + abundout(l) + kount = kount + 1 + endif + enddo + if (kount .gt. 0) then + average = average/kount + endif + deviate = 0. + if (kount .gt. 1) then + do l=lim1obs,lim2obs + if (abundout(l) .ne. 999.99) then + deviate = deviate + (abundout(l)-average)**2 + endif + enddo + deviate = dsqrt(deviate/(kount-1)) + endif + + +c*****correlate the abundances with excitation potential, equivalent width, +c and wavelength + if (kount .gt. 2) then + epmin = 999. + epmax = -999. + rwmin = 999. + rwmax = -999. + wvmin = 999999. + wvmax = -999999. + x1 = 0. + x2 = 0. + x3 = 0. + x4 = 0. + x5 = 0. + x6 = 0. + y1 = 0. + y2 = 0. + xy = 0. + yz = 0. + za = 0. + + do l=lim1obs,lim2obs + if (abundout(l) .ne. 999.99) then +c rw = dlog10(wid1comp(l)/wave1(l)) + rw = dlog10(width(l)/wave1(l)) + x1 = x1 + e(l,1) + x2 = x2 + e(l,1)**2 + x3 = x3 + rw + x4 = x4 + rw**2 + x5 = x5 + wave1(l) + x6 = x6 + wave1(l)**2 + y1 = y1 + abundout(l) + y2 = y2 + abundout(l)**2 + xy = xy + e(l,1)*abundout(l) + yz = yz + rw*abundout(l) + za = za + wave1(l)*abundout(l) + if (e(l,1) .lt. epmin) epmin = e(l,1) + if (e(l,1) .gt. epmax) epmax = e(l,1) + if (rw .lt. rwmin) rwmin = rw + if (rw .gt. rwmax) rwmax = rw + if (wave1(l) .lt. wvmin) wvmin = wave1(l) + if (wave1(l) .gt. wvmax) wvmax = wave1(l) + endif + enddo + + xxm1 = (kount*xy - x1*y1)/(kount*x2 - x1**2) + xxb1 = (y1*x2 - xy*x1)/(kount*x2 - x1**2) + xxr1 = (kount*xy - x1*y1)/dsqrt((kount*x2 - x1**2)* + . (kount*y2 - y1**2)) + deltaep = epmax - epmin + + xxm2 = (kount*yz - x3*y1)/(kount*x4 - x3**2) + xxb2 = (y1*x4 - yz*x3)/(kount*x4 - x3**2) + xxr2 = (kount*yz - x3*y1)/dsqrt((kount*x4 - x3**2)* + . (kount*y2 - y1**2)) + deltarw = rwmax - rwmin + + xxm3 = (kount*za - x5*y1)/(kount*x6 - x5**2) + xxb3 = (y1*x6 - za*x5)/(kount*x6 - x5**2) + xxr3 = (kount*za - x5*y1)/dsqrt((kount*x6 - x5**2)* + . (kount*y2 - y1**2)) + deltawv = wvmax - wvmin + + endif + + return + end + + diff --git a/Sunder.f b/Sunder.f new file mode 100755 index 0000000..8bf956b --- /dev/null +++ b/Sunder.f @@ -0,0 +1,24 @@ + + subroutine sunder (amol,i1,i2) +c****************************************************************************** +c This routine breaks up molecule amol into leftmost atom i1 and +c the rest of the molecule i2 +c****************************************************************************** + + implicit real*8 (a-h,o-z) + dimension itest(5) + data itest/100000000,1000000,10000,100,1/ + + im = nint(amol) + + do i=1,5 + i1 = im/itest(i) + if (i1 .eq. 0) cycle + i2 = im - i1*itest(i) + exit + enddo + + return + + end + diff --git a/Synpop.f b/Synpop.f new file mode 100755 index 0000000..7d07ff7 --- /dev/null +++ b/Synpop.f @@ -0,0 +1,304 @@ + + subroutine synpop +c****************************************************************************** +c Synthetic spectrum routine for stellar populations; usually meant for +c integrated light spectra. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Quants.com' + include 'Linex.com' + include 'Factor.com' + include 'Mol.com' + include 'Pstuff.com' + include 'Multimod.com' + real*8 tempspec(5,10000), rspec(10000) + character*80 holdline(5,30) + character*80 line + + +c*****read the parameter file + call params + + +c*****open the model table input file and the summary table output file; +c read the information from the table input file + call tablepop (2) + + +c*****open the standard output file +60 nf1out = 20 + lscreen = 8 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + + +c*****FIRST PASS: For each model, compute a raw synthetic spectrum; +c*****the starting do/if loops are for isotopic things only + xhyd = 10.0**xsolar(1) + do mmod=1,modtot + if (numiso .gt. 0) then + if (nisos .gt. 0) then + do k=1,numiso + do l=1,nisos + if (isotope(k) .eq. isospecial(l)) then + do m=1,numisosyn + isoabund(k,m) = fracspecial(mmod,l) + enddo + endif + enddo + enddo + endif + endif + + +c*****read in the model atmospheres and their summary output files + line = synpre + num = 80 + call getcount (num,line) + if (mmod .lt. 10) then + write (line(num+1:num+1),1013) mmod + else + write (line(num+1:num+2),1014) mmod + endif + nf2out = 21 + fmodoutput(mmod) = line + f2out = fmodoutput(mmod) + lscreen = 12 + array = 'INDIVIDUAL MODEL RAW SYNTHESIS OUTPUT' + nchars = 37 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + line = modpre + num = 80 + call getcount (num,line) + if (mmod .lt. 10) then + write (line(num+1:num+1),1013) mmod + else + write (line(num+1:num+2),1014) mmod + endif + nfmodel = 30 + fmodinput(mmod) = line + fmodel = fmodinput(mmod) + lscreen = 14 + array = 'INDIVIDUAL MODEL ATMOSPHERE' + nchars = 27 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + write (nf2out,1001) moditle + + +c*****change the "default" abundances to be the ones read from the table file + do i=1,nabs + iabund = nint(elspecial(i)) + xabu(iabund) = 10.**abspecial(mmod,i)/xhyd + enddo + + +c*****open the line list file and the strong line list file + nflines = 31 + lscreen = 16 + array = 'THE LINE LIST' + nchars = 13 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + if (dostrong .gt. 0) then + nfslines = 32 + lscreen = 18 + array = 'THE STRONG LINE LIST' + nchars = 20 + call infile ('input ',nfslines,'formatted ',0,nchars, + . fslines,lscreen) + endif + + +c*****do the syntheses + ncall = 1 + if (numpecatom .eq. 0 .or. numatomsyn .eq. 0) then + isorun = 1 + nlines = 0 + mode = 3 + call inlines (1) + call eqlib + call nearly (1) + call synspec + else + do n=1,numatomsyn + isynth = n + isorun = n + start = oldstart + sstop = oldstop + mode = 3 + call inlines (1) + call eqlib + call nearly (1) + call synspec + linprintopt = 0 + enddo + endif + fluxmod(mmod,1) = flux + call finish (0) + enddo + + +c*****clear the mean spectrum array and the information array + do i=1,5 + do j=1,10000 + tempspec(i,j) = 0. + enddo + enddo + do i=1,5 + do j=1,30 + write (holdline(i,j),1008) + enddo + enddo + + +c*****open the file where the mean raw spectrum will be written + nf9out = 23 + lscreen = 10 + array = 'MEAN RAW SYNTHESIS OUTPUT' + nchars = 25 + call infile ('output ',nf9out,'formatted ',0,nchars, + . f9out,lscreen) + + +c*****compute normalized weights + weighttot = 0. + do mmod=1,modtot + weightmod(mmod,1) = fluxmod(mmod,1)*radius(mmod)**2* + . relcount(mmod) + weighttot = weighttot + weightmod(mmod,1) + enddo + do mmod=1,modtot + weightmod(mmod,1) = weightmod(mmod,1)/weighttot + enddo + + +c*****read back the syntheses, compute the weighted average + do mmod=1,modtot + newunit = 26 + open (newunit,file=fmodoutput(mmod)) + read (newunit,1001) line + do j=1,numatomsyn + lincount = 0 +50 read (newunit,1001) line + lincount = lincount + 1 + if (mmod .eq. 1) write (holdline(j,lincount),1001) line + if (line(1:5) .eq. 'MODEL') then + read (newunit,1001) line + lincount = lincount + 1 + if (mmod .eq. 1) write (holdline(j,lincount),1001) line + read (line,*) wavemod1, wavemod2, wavestep + nw1 = nint(1000.*wavemod1) + nw2 = nint(1000.*wavemod2) + nws = nint(1000.*wavestep) + nnn = (nw2-nw1)/nws + 1 + read (newunit,*) (rspec(n),n=1,nnn) + do n=1,nnn + tempspec(j,n) = tempspec(j,n) + weightmod(mmod,1)* + . rspec(n) + enddo + else + go to 50 + endif + enddo + close (unit=newunit) + enddo + + +c write the average spectrum back to disk. + line(1:7) = 'MODEL: ' + line(8:80) = popitle(1:73) + do j=1,numatomsyn + holdline(j,lincount-1) = line + write (nf9out,1001) (holdline(j,l),l=1,lincount) + write (nf9out,1003) (tempspec(j,n),n=1,nnn) + enddo + close (unit=nf9out) + + +c*****now plot the spectrum + if (plotopt.eq.2 .and. specfileopt.gt.0) then + nfobs = 33 + lscreen = 12 + array = 'THE OBSERVED SPECTRUM' + nchars = 21 + if (specfileopt.eq.1 .or. specfileopt.eq.3) then + call infile ('input ',nfobs,'unformatted',2880,nchars, + . fobs,lscreen) + else + call infile ('input ',nfobs,'formatted ',0,nchars, + . fobs,lscreen) + endif + endif + if (plotopt .ne. 0) then + nf2out = nf9out + f2out = f9out + nf2out = 21 + lscreen = lscreen + 2 + array = 'RAW SYNTHESIS OUTPUT' + nchars = 20 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + nf3out = 22 + lscreen = lscreen + 2 + array = 'SMOOTHED SYNTHESES OUTPUT' + nchars = 25 + call infile ('output ',nf3out,'formatted ',0,nchars, + . f3out,lscreen) + if (f5out .ne. 'optional_output_file') then + nf5out = 26 + lscreen = lscreen + 2 + array = 'POSTSCRIPT PLOT OUTPUT' + nchars = 22 + call infile ('output ',nf5out,'formatted ',0,nchars, + . f5out,lscreen) + endif + if (plotopt .eq. 3) then + call smooth (-1,ncall) + choice = 'q' + else + call pltspec (lscreen,ncall) + endif + + +c*****if needed, loop back with abundance changes + if (choice .eq. 'n') then + call chabund + if (choice .eq. 'q') go to 60 + endif + endif + + +c*****format statements +1001 format (a80) +1002 format ('POPULATION SYNTHESIS FOR INTEGRATED-LIGHT SPECTRA'/a80) +1003 format (10f7.4) +1004 format (a30, 2x, a10, 3f8.0) +1005 format ('#models =', i3, 5x, 'total weight =', f7.2// + . ('model#', i5, 5x, 'relative weight', f8.2)) +1006 format (i3, 1x, f8.0, 2f8.2, 10f6.2) +1008 format (80(' ')) +1009 format ('SPECIAL ELEMENTS OR NAMES OF ISOTOPES'/(10i8)) +1010 format ('NO DECLARED SPECIAL ELEMENTS') +1011 format ('SPECIAL ISOTOPE NAMES'/((5f10.5))) +1012 format ('NO DECLARED SPECIAL ISOTOPES') +1013 format (i1) +1014 format (i2) +1015 format (6f13.5) + + + end + + + + + + + + diff --git a/Synspec.f b/Synspec.f new file mode 100755 index 0000000..6fbe5d7 --- /dev/null +++ b/Synspec.f @@ -0,0 +1,182 @@ +
+ subroutine synspec
+c******************************************************************************
+c This routine does synthetic spectra
+c******************************************************************************
+
+ implicit real*8 (a-h,o-z)
+ include 'Atmos.com'
+ include 'Linex.com'
+ include 'Factor.com'
+ include 'Pstuff.com'
+ include 'Dummy.com'
+ real*8 dd(5000)
+
+c*****initialize the synthesis
+ write (nf1out,1101)
+ write (nf2out,1002) moditle(1:73)
+ if (iunits .eq. 1) then
+ write (nf2out,1103) start/1.d4, sstop/1.d4,
+ . step/1.d4, delta/1.d4
+ else
+ write (nf2out,1102) start,sstop,step,delta
+ endif
+ if (iraf .eq. 1) then
+ npoint = (sstop-start)/step
+ write (nf4out,1104) npoint,wave,wave,step,step
+ write (nf4out,1105)
+ write (nf4out,1106) moditle
+ do j=1,93
+ if (pec(j) .gt. 0 ) then
+ dummy1(j) = dlog10(xabund(j)) + 12.0
+ write (nf4out,1107) names(j),dummy1(j)
+ endif
+ enddo
+ write (nf4out,1108) vturb(1)
+ write (nf4out,1109)
+ endif
+ if (mode .ne. 4) then
+ lim1line = 0
+ lim2line = 0
+ lim1obs = 0
+ lim2obs = 0
+ lim1 = 0
+ lim2 = 0
+ endif
+
+
+c*****now step in wavelength as the spectrum is computed
+ kount = nint((sstop - start + (step/4.0) )/step) + 1
+ num = 0
+ wavl = 0.
+
+
+c*****first calculate or recalculated continuum quantities at the
+c spectrum wavelength, if needed
+ do n=1,kount
+ num = num + 1
+ wave = oldstart + (n-1)*step
+ if (dabs(wave-wavl)/wave .ge. 0.001) then
+ wavl = wave
+ call opacit (2,wave)
+ if (modprintopt .ge. 2)
+ . write (nf1out,1001) wave,(kaplam(i),i=1,ntau)
+ call cdcalc (1)
+ first = 0.4343*cd(1)
+ flux = rinteg(xref,cd,dummy1,ntau,first)
+ if (iunits .eq. 1) then
+ write (nf1out,1003) 1.d-4*wave,flux
+ else
+ write (nf1out,1004) wave,flux
+ endif
+ endif
+
+
+c*****find the appropriate set of lines for this wavelength, reading
+c in a new set if this is the initial depth calculation or if
+c needed because the line list end has been reached
+ if (mode .eq. 3) then
+20 call linlimit
+ if (lim2line .lt. 0) then
+ call inlines (2)
+ call nearly (1)
+ go to 20
+ endif
+ lim1 = lim1line
+ lim2 = lim2line
+ endif
+
+
+c*****compute a spectrum depth at this point; if there are no absorption
+c lines in the interval then just set the depth to zero without
+c extensive line calculations
+ if (lineflag .lt. 0) then
+ d(num) = 0.
+ else
+ call taukap
+ call cdcalc (2)
+ first = 0.4343*cd(1)
+ d(num) = rinteg(xref,cd,dummy1,ntau,first)
+ endif
+ if (mod(n,10) .eq. 0) then
+ if (iraf .eq. 1) then
+ do j = 1,10
+ dd(num-10+j) = 1. - d(num-10+j)
+ enddo
+ write (nf4out,1110) (dd(num-10+j),j=1,10)
+ endif
+ if (iunits .eq. 1) then
+ wave3 = 1.d-4*(wave - 9.0*step)
+ write (nf1out,1112) wave3,(d(num-10+j),j=1,10)
+ else
+ wave3 = wave - 9.0*step
+ write (nf1out,1111) wave3,(d(num-10+j),j=1,10)
+ endif
+ if (nf2out .gt. 0) write (nf2out,1110) (d(num-10+j),j=1,10)
+ endif
+ if (num .ge. 5000) num = 0
+ enddo
+
+
+c*****finish the synthesis
+ nn = mod(num,10)
+ if (nn .ne. 0) then
+ if (iraf .eq. 1) then
+ do j=1,nn
+ dd(num-nn+j) = 1. - d(num-nn+j)
+ enddo
+ write (nf4out,1110) (dd(num-nn+j),j=1,nn)
+ endif
+ if (iunits .eq. 1) then
+ wave3 = 1.d-4*(wave - 9.0*step)
+ write (nf1out,1112) wave3,(d(num-nn+j),j=1,nn)
+ else
+ wave3 = wave - 9.0*step
+ write (nf1out,1111) wave3,(d(num-nn+j),j=1,nn)
+ endif
+ if (nf2out .gt. 0) write (nf2out,1110) (d(num-nn+j),j=1,nn)
+ endif
+ if (iunits .eq. 1) then
+ write (nf1out,1113) 1.d-4*wave
+ else
+ write (nf1out,1114) wave
+ endif
+
+
+c*****exit normally
+ return
+
+
+c*****format statements
+1001 format (' kaplam from 1 to ntau at wavelength',f10.2/
+ . (6(1pd12.4)))
+1002 format ('MODEL: ',a73)
+1003 format ('AT WAVELENGTH/FREQUENCY =',f11.7,
+ . ' CONTINUUM FLUX/INTENSITY =',1p,d12.5)
+1004 format ('AT WAVELENGTH/FREQUENCY =',f11.3,
+ . ' CONTINUUM FLUX/INTENSITY =',1p,d12.5)
+1101 format (/'SPECTRUM DEPTHS')
+1102 format (4f11.3)
+1103 format (4f10.7)
+1104 format ('SIMPLE = T / Fits standard'/
+ . 'NAXIS = 1'/'NAXIS1 = ',i10,/
+ . 'W0 =',f10.4/'CRVAL1 =',f10.4/'WPC =',f10.4/
+ . 'CDELT1 =',f10.4)
+1105 format (16HORIGIN = 'moog'/21HDATA-TYP= 'synthetic'/
+ . 18HCTYPE1 = 'lambda'/21HCUNIT1 = 'angstroms')
+1106 format (11HTITLE = ',A65,1H')
+1107 format ('ATOM = ',1H',7x,a2,1H',/,'ABUND = ',f10.2)
+1108 format ('VTURB = ',d10.4,' / cm/sec ')
+1109 format ('END')
+1110 format (10f7.4)
+1111 format (f10.3,': depths=',10f6.3)
+1112 format (f10.7,': depths=',10f6.3)
+1113 format ('FINAL WAVELENGTH/FREQUENCY =',f10.7/)
+1114 format ('FINAL WAVELENGTH/FREQUENCY =',f10.3/)
+
+
+ end
+
+
+
+
@@ -0,0 +1,153 @@ + + subroutine synth +c****************************************************************************** +c This program synthesizes a section of spectrum and compares it +c to an observation file. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Factor.com' + include 'Mol.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Dummy.com' + + +c*****examine the parameter file + call params + + +c*****open the files for: standard output, raw spectrum depths, smoothed +c spectra, and (if desired) IRAF-style smoothed spectra + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf2out = 21 + lscreen = lscreen + 2 + array = 'RAW SYNTHESIS OUTPUT' + nchars = 20 + call infile ('output ',nf2out,'formatted ',0,nchars, + . f2out,lscreen) + if (plotopt .ne. 0) then + nf3out = 22 + lscreen = lscreen + 2 + array = 'SMOOTHED SYNTHESES OUTPUT' + nchars = 25 + call infile ('output ',nf3out,'formatted ',0,nchars, + . f3out,lscreen) + if (f5out .ne. 'optional_output_file') then + nf5out = 26 + lscreen = lscreen + 2 + array = 'POSTSCRIPT PLOT OUTPUT' + nchars = 22 + call infile ('output ',nf5out,'formatted ',0,nchars, + . f5out,lscreen) + endif + endif + if (iraf .ne. 0) then + nf4out = 23 + lscreen = lscreen + 2 + array = 'IRAF ("rtext") OUTPUT' + nchars = 24 + call infile ('output ',nf4out,'formatted ',0,nchars, + . f4out,lscreen) + endif + + +c*****open and read the model atmosphere file + nfmodel = 30 + lscreen = lscreen + 2 + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + + +c*****open the line list file and the strong line list file + nflines = 31 + lscreen = lscreen + 2 + array = 'THE LINE LIST' + nchars = 13 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + if (dostrong .gt. 0) then + nfslines = 32 + lscreen = lscreen + 2 + array = 'THE STRONG LINE LIST' + nchars = 20 + call infile ('input ',nfslines,'formatted ',0,nchars, + . fslines,lscreen) + endif + + +c*****do the syntheses + choice = '1' + do i=1,100 + if (i .eq. 100) then + write (*,1002) + stop + endif + ncall = 1 + call getsyns (lscreen,ncall) + + +c*****now either don't make a plot (plotopt = 0) +c plot the synthetic spectrum, (plotopt = 1) +c plot syntheses and observation (plotopt = 2) +c or just smooth the syntheses (plotopt = 3) + if (choice .eq. 'n') then + ncall = 2 + else + ncall = 1 + endif + if (plotopt .eq. 0) then + choice = 'q' + elseif (plotopt .eq. 1) then + call pltspec (lscreen,ncall) + elseif (plotopt .eq. 2) then + nfobs = 33 + lscreen = lscreen + 2 + array = 'THE OBSERVED SPECTRUM' + nchars = 21 + if (specfileopt .eq. 1) then + call infile ('input ',nfobs,'unformatted',2880,nchars, + . fobs,lscreen) + else + call infile ('input ',nfobs,'formatted ',0,nchars, + . fobs,lscreen) + endif + call pltspec (lscreen,ncall) + elseif (plotopt .eq. 3) then + call smooth (-1,ncall) + choice = 'q' + else + write (*,1001) + stop + endif + if (choice .eq. 'q') then + call finish (0) + exit + endif + enddo + + + +c*****format statements +1001 format ('for syntheses, parameter "plot" must be 0, 1, 2, or 3;', + . ' I QUIT!') +1002 format ('something wrong: max number (99) of synthesis ', + . 'cycles exceeded; I QUIT!') + + + + end + + + + + diff --git a/Tablepop.f b/Tablepop.f new file mode 100755 index 0000000..de5be03 --- /dev/null +++ b/Tablepop.f @@ -0,0 +1,171 @@ + + subroutine tablepop (option) +c****************************************************************************** +c this routine opens the table file containing information for a stellar +c population, and reads the data in that file; the information is a +c bit different for "abpop" and "synpop" +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Multimod.com' + include 'Pstuff.com' + integer option + character*80 line + + +c*****open the model table input file and the summary table output file + nftable = 18 + lscreen = 4 + array = 'MODEL TABLE INPUT FILE' + nchars = 22 + call infile ('input ',nftable,'formatted ',0,nchars, + . ftable,lscreen) + nf7out = 24 + lscreen = 6 + array = 'MODEL TABLE OUTPUT FILE' + nchars = 18 + call infile ('output ',nf7out,'formatted ',0,nchars, + . f7out,lscreen) + + +c*****read the table input for integrated light EW matching + if (option .eq. 1) then + read (nftable,1001) line + if (line(1:5) .ne. 'abpop' ) then + write(*,*) 'OOPS! WRONG TABLE FOR ABPOP; I QUIT!' + stop + endif + do i=1,1000 + read (nftable,1001) line + if (line(1:5) .eq. 'modpr') then + call blankstring (modpre) + modpre(1:70) = line(11:80) + elseif (line(1:5) .eq. 'synpr') then + call blankstring (synpre) + synpre(1:70) = line(11:80) + elseif (line(1:5) .eq. 'title') then + call blankstring (abitle) + popitle(1:74) = line(7:80) + write (nf7out,1002) popitle(1:73) + elseif (line(1:5) .eq. 'model') then + do mmod=1,100 + if (mmod .eq. 100) then + write(*,*) 'MORE THAN 99 MODELS; I QUIT!' + stop + endif + read (nftable,*,end=10) j, radius(mmod), + . relcount(mmod) + enddo + endif + enddo + + +c*****read the table input for integrated light spectrum syntheses + else + nabs = 0 + nisos = 0 + read (nftable,1001) line(1:80) + if (line(1:6) .ne. 'synpop') then + write (*,*) 'OOPS! WRONG TABLE FOR SYNPOP; I QUIT!' + stop + endif + do k=1,1000 + call blankstring (line) + read (nftable,1001) line(1:80) + if (line(1:5) .eq. 'modpr') then + call blankstring (modpre) + modpre(1:70) = line(11:80) + elseif (line(1:5) .eq. 'synpr') then + call blankstring (synpre) + synpre(1:70) = line(11:80) + elseif (line(1:5) .eq. 'title') then + call blankstring (popitle) + popitle(1:74) = line(7:80) + write (nf7out,1003) popitle(1:74) + elseif (line(1:5) .eq. 'abund') then + read (line(12:80),*) nabs + if (nabs .gt. 0) then + read (nftable,1001) line(1:80) + read (line(1:80),*) (elspecial(i),i=1,nabs) + write (nf7out,1009) (nint(elspecial(i)),i=1,nabs) + else + write (nf7out,1010) + endif + elseif (line(1:5) .eq. 'isoto') then + read (line(10:80),*) nisos + if (nisos .gt. 0) then + read (nftable,1001) line(1:80) + read (line(1:80),*) (isospecial(i),i=1,nisos) + write (nf7out,1011) (isospecial(i),i=1,nisos) + else + write (nf7out,1012) + endif + elseif (line(1:5) .eq. 'model') then + do mmod=1,100 + if (mmod .eq. 100) then + write (*,*) 'MORE THAN 99 MODELS; I QUIT!' + stop + endif + if (nabs.le.0 .and. nisos.le.0) then + read (nftable,*,end=10) j, radius(mmod), + . relcount(mmod) + write (nf7out,1006) j, radius(mmod), + . relcount(mmod) + elseif (nabs.gt.0 .and. nisos.le.0) then + read (nftable,*,end=10) j, radius(mmod), + . relcount(mmod), + . (abspecial(mmod,i),i=1,nabs) + write (nf7out,1006) j, radius(mmod), + . relcount(mmod), + . (abspecial(mmod,i),i=1,nabs) + elseif (nabs.le.0 .and. nisos.gt.0) then + read (nftable,*,end=10) j, radius(mmod), + . relcount(mmod), + . (fracspecial(mmod,i),i=1,nisos) + write (nf7out,1006) j, radius(mmod), relcount(mmod) + write (nf7out,1015) (fracspecial(mmod,i),i=1,nisos) + else + read (nftable,*,end=10) j, radius(mmod), + . relcount(mmod), + . (abspecial(mmod,i),i=1,nabs), + . (fracspecial(mmod,i),i=1,nisos) + write (nf7out,1006) j, radius(mmod), + . relcount(mmod), + . (abspecial(mmod,i),i=1,nabs) + write (nf7out,1015) (fracspecial(mmod,i),i=1,nisos) + endif + enddo + endif + enddo + endif + + +c*****close the model input file, exit normally + 10 close (unit=nftable) + modtot = mmod-1 + return + + +c*****format statements +1001 format (a80) +1002 format ('EQUIVALENT WIDTH ANALYSIS FOR INTEGRATED-LIGHT SPECTRA'// + . a80) +1003 format ('POPULATION SYNTHESIS FOR INTEGRATED-LIGHT SPECTRA'/a80) +1006 format (i3, 1x, f8.0, 2f8.2, 10f6.2) +1009 format ('SPECIAL ELEMENTS OR NAMES OF ISOTOPES'/(10i8)) +1010 format ('NO DECLARED SPECIAL ELEMENTS') +1011 format ('SPECIAL ISOTOPE NAMES'/((5f10.5))) +1012 format ('NO DECLARED SPECIAL ISOTOPES') +1015 format (6f13.5) + + + end + + + + + + + + diff --git a/Taukap.f b/Taukap.f new file mode 100755 index 0000000..12f2c61 --- /dev/null +++ b/Taukap.f @@ -0,0 +1,48 @@ + + subroutine taukap +c****************************************************************************** +c This routine calculates the line absorption coefficient and the line +c opacity at wavelength *wave* for all lines in the spectrum +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Dummy.com' + + +c*****compute the total line opacity at each depth + do i=1,ntau + kapnu(i) = 0.0 + do j=lim1,lim2 + v = 2.997929d10*dabs(wave-wave1(j))/ + . (wave1(j)*dopp(j,i)) + kapnu(i) = kapnu(i) + kapnu0(j,i)*voigt(a(j,i),v) + enddo + + dummy1(i) = tauref(i)*kapnu(i)/(0.4343*kapref(i)) + +c*****do the same for the strong lines + if (dostrong .gt. 0) then + do j=nlines+1,nlines+nstrong + v = 2.997929d10*dabs(wave-wave1(j))/ + . (wave1(j)*dopp(j,i)) + kapnu(i) = kapnu(i) + kapnu0(j,i)*voigt(a(j,i),v) + enddo + endif + + dummy1(i) = tauref(i)*kapnu(i)/(0.4343*kapref(i)) + enddo + +c*****compute the optical depths + first = tauref(1)*kapnu(1)/kapref(1) + dummy1(1) = rinteg(xref,dummy1,taunu,ntau,0.) + taunu(1) = first + do i=2,ntau + taunu(i) = taunu(i-1) + taunu(i) + enddo + + + return + end + @@ -0,0 +1,63 @@ + + subroutine total +c****************************************************************************** +c This routine integrates to get an equivalent width. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Dummy.com' + real*8 waveint(5000), depthint(5000) + equivalence (waveint,dummy3), (depthint,dummy4) + + +c*****compute the wavelength array + ntotal = (sstop - start)/step + 1.3 + if (ntotal .gt. 5000) then + write (nf1out,1002) ntotal + write (nf2out,1002) ntotal + return + endif + do i=1,ntotal + waveint(i) = start + step*(i-1) + enddo + + +c*****use the RINTEG routine to do an integration + answer = 1000.*rinteg(waveint,d,depthint,ntotal,0.) + write (nf1out,1001) answer, ntotal + write (nf2out,1001) answer, ntotal + w(ncurve) = answer/1000. + + +c*****Then recheck using Simpson's rule + ntot = ntotal + if(ntotal/2*2 - ntotal .eq. 0) ntot = ntotal - 1 + answer = d(1) + 4.*d(2) + d(ntot) + ntot = ntot - 2 + do i=3,ntot,2 + answer = answer + 2.*d(i) + 4.*d(i+1) + enddo + answer = 1000.*step/3.*answer + write (nf1out,1006) answer + write (nf2out,1006) answer + return + + +c*****format statements +1001 format (' equivalent width: ',f8.2,' mA.',5x, + . 5x,'number of points: ',i5) +1002 format (i7,' POINTS ARE TOO MANY FOR THE INTEGRATION') +1006 format(' Simpson rule check on equivalent width =',f8.2) + + + end + + + + + + + diff --git a/Trudamp.f b/Trudamp.f new file mode 100755 index 0000000..4ad869c --- /dev/null +++ b/Trudamp.f @@ -0,0 +1,166 @@ + + subroutine trudamp (linnum) +c************************************************************************* +c This routine calculates damping parameters for lines that have +c accurately known laboratory damping parameters +c THE USER IS WARNED THAT THESE FORMULAE ARE OLD AND NOT EASILY +c DEFENDED; THE BARKLEM NUMBERS ARE TO BE PREFERRED. +c************************************************************************* + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + + +c*****begin with some calculations leading to a c6 value ("unsold") + j = linnum + iwave = int(wave1(j)) + iatom10 = nint(10.*atom1(j)) + ich = nint(charge(j)) + unsold = dabs(1.61d-33*(13.5*charge(j)/(chi(j,ich) - + . e(j,1)))**2 - 1.61d-33*(13.5*charge(j)/ + . (chi(j,ich)-e(j,2)))**2) + + +c*****Ca II "IR triplet" lines at the Ca II K line at 3934 A + if (iatom.eq.201 .and. iwave.eq.3933) then + do i=1,ntau + gammaa = 1.45d+8 + gnature = gammaa + 0.5*1.5d-9*t(i)**(1/3)*numdens(1,1,i) + gvander = 1.6d-8 * (t(i)/5000.)**0.3 * numdens(1,1,i) + gstark = 3.0d-6 * ne(i) + gammadamp = anature + gvander + gstark + a(j,i) = gammadamp*wave1(j)*1.0e-8/(12.56636*dopp(j,i)) + write (nf1out,1001) gnature, gstark, gvander, + . gammadamp, a(j,i) + enddo + return + + +c*****Ca II "IR triplet" lines at 8498, 8542, and 8662 A + elseif (iatom10.eq.201 .and. + . (iwave.eq.8498.or. + . iwave.eq.8542.or. + . iwave.eq.8662)) then + write (nf1out,1000) + do i=1,ntau + nhe = xabund(2)*nhtot(i) + gnature = 1.5e+08 + gstark = 1.5e-06*ne(i)*(t(i)/5000.)**0.1666 + ghelium = 3.0e-09*nhe*(t(i)/5000.)**0.4 + ghydro = 1.0e-08*nhtot(i)*(t(i)/5000.)**0.4 + gammadamp = gnature/2. + gstark + ghelium + ghydro + a(j,i) = gammadamp*wave1(j)*1.0e-8/(12.56636*dopp(j,i)) + v1 = dsqrt(2.1175d8*t(i)*(1.0/amass(j)+1.008)) + gvander = 17.0*unsold**0.4*v1**0.6*nhtot(i) + avander = gvander*wave1(j)*1.0d-8/(12.56636*dopp(j,i)) + write (nf1out,1001) gnature, gstark, ghelium, ghydro, + . gammadamp, a(j,i), avander + enddo + return + + +c*****Ca I 6717 A + elseif (iatom10.eq.200 .and. iwave.eq.6717) then + write (nf1out,1002) iwave + do i=1,ntau + nhe = xabund(2)*nhtot(i) + gnature = 0.4e-08 + ghelium = 1.0e-09*nhe*(t(i)/5000.)**0.4 + ghydro = 2.0e-08*nhtot(i)*(t(i)/5000.)**0.4 + gammadamp = gnature/2. + ghelium + ghydro + gammadamp = gammadamp*2. + a(j,i) = gammadamp*wave1(j)*1.0e-8/(12.56636*dopp(j,i)) + v1 = dsqrt(2.1175d8*t(i)*(1.0/amass(j)+1.008)) + gvander = 17.0*unsold**0.4*v1**0.6*nhtot(i) + avander = gvander*wave1(j)*1.0d-8/(12.56636*dopp(j,i)) + write (nf1out,1001) gnature, ghelium, ghydro, + . gammadamp, a(j,i), avander + enddo + return + + +c*****Ca I 6318, 6343, 6361 A autoionization lines + elseif (iatom10.eq.200 .and. + . (iwave.eq.6318 .or. + . iwave.eq.6343 .or. + . iwave.eq.6361)) then + write (nf1out,1005) iwave + do i=1,ntau + if (dampnum(j) .eq. 0) then + gnature = 1.5d12 + else + gnature = dampnum(j)*1.5d12 + endif + gammadamp = gnature + a(j,i) = gammadamp*wave1(j)*1.0e-8/(12.56636*dopp(j,i)) + write (nf1out,1001) gnature, gammadamp, a(j,i) + enddo + return + + +c*****Na I lines + elseif (iatom .eq. 110) then + write (nf1out,1003) iwave + do i=1,ntau + gnature = 2.21e+15/wave1(j)**2 + v1 = dsqrt(2.1175d8*t(i)*(1.0/amass(j)+1.008)) + gvander = 17.0*unsold**0.4*v1**0.6*nhtot(i) + gcoll = gvander*2.1 + gammadamp = gnature/2. + gcoll + a(j,i) = gammadamp*wave1(j)*1.0e-8/(12.56636*dopp(j,i)) + avander = gvander*wave1(j)*1.0d-8/(12.56636*dopp(j,i)) + write (nf1out,1001) gnature, gcoll, gammadamp, + . a(j,i), avander + enddo + return + + +c*****CH autoionization line at 3693 A + elseif (iatom10.eq.1060 .and. + . iwave.eq.3693) then + write (nf1out,1006) iwave + do i=1,ntau + if (dampnum(j) .eq. 0) then + gnature = 4.0d11 + else + gnature = dampnum(j)*4.0d11 + endif + gammadamp = gnature + a(j,i) = gammadamp*wave1(j)*1.0e-8/(12.56636*dopp(j,i)) + write (nf1out,1001) gnature, gammadamp, a(j,i) + enddo + return + endif + + +c*****format statements +1000 format(//' LINE BROADENING PARAMETERS FOR ', + . 'CaII INFRARED TRIPLET'/ + . 4x,'natural',6x,'stark',5x,'helium',3x,'hydrogen', + . 6x,'gammadamp',5x,'a(j,i)',5x,'a(VdW)') +1001 format (1p7e11.3) +1002 format(//' LINE BROADENING PARAMETERS FOR ', + . 'CaI LINE AT',i6/ + . 4x,'natural',5x,'helium',3x,'hydrogen', + . 6x,'gammadamp',5x,'a(j,i)',5x,'a(VdW)') +1003 format(//' LINE BROADENING PARAMETERS FOR ', + . 'NaI LINE AT',i6/ + . 4x,'natural',4x,'VdW*1.2',6x,'gammadamp', + . 5x,'a(j,i)',5x,'a(VdW)') +1004 format(//' LINE BROADENING PARAMETERS FOR ', + . 'CaI LINE AT 6318A'/ + . 4x,'natural',6x,'Stark',4x,'vdwaals', + . 6x,'gammadamp',5x,'a(j,i)') +1005 format(//' LINE BROADENING PARAMETERS FOR ', + . 'THE CaI AUTOIONIZATION LINE AT',i6/ + . 4x,'natural', 2x,'gammadamp',5x,'a(j,i)') +1006 format(//' LINE BROADENING PARAMETERS FOR ', + . 'THE CH AUTOIONIZATION LINE AT',i6/ + . 4x,'natural', 2x,'gammadamp',5x,'a(j,i)') + + + end + + + + @@ -0,0 +1,60 @@ + + real*8 function ucalc (atom,level) +c****************************************************************************** +c This routine decodes the partition function data. the source +c is the atlas program of kurucz +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Quants.com' + dimension scale(4) + data scale/0.001,0.01,0.1,1.0/ + + if (level .gt. 500) then + temp = level + else + temp = t(level) + endif + + iatom = nint(atom) + ion = nint(10.*(atom - float(iatom))) + j = 4*(iatom-1) + ion + 1 + + if (ion .eq. 0) then + chix = xchi1(iatom) + elseif (ion .eq. 1) then + chix = xchi2(iatom) + else + chix = xchi3(iatom) + endif + + t2000 = chix*2000./11. + it = max0(1,min0(9,idint(temp/t2000-0.5))) + dt = temp/t2000 - float(it) - 0.5 + pmin = 1. + i = (it+1)/2 + k1 = nudata(i,j)/100000 + k2 = nudata(i,j) - k1*100000 + k3 = k2/10 + kscale = k2 - k3*10 + if (mod(it,2) .eq. 0) then + p1 = float(k3)*scale(kscale) + k1 = nudata(i+1,j)/100000 + kscale = mod(nudata(i+1,j),10) + p2 = float(k1)*scale(kscale) + else + p1 = float(k1)*scale(kscale) + p2 = float(k3)*scale(kscale) + if (dt .ge. 0.) go to 13 + if (kscale .gt. 1.) go to 13 + kp1 = p1 + if (kp1 .ne. idint(p2+0.5)) go to 13 + pmin = kp1 + endif +13 ucalc = dmax1(pmin,p1+(p2-p1)*dt) + + return + end + + diff --git a/Vargauss.f b/Vargauss.f new file mode 100755 index 0000000..199f67f --- /dev/null +++ b/Vargauss.f @@ -0,0 +1,220 @@ + + subroutine vargauss (line) +c****************************************************************************** +c This subroutine prepares synthesis data for plotting by smoothing +c the data with a Gaussian whose FWHM has been specified by the user +c at various wavelengths along the spectrum +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + include 'Equivs.com' + real*8 wavefwhm(100),fwhm(100) + character*80 fsmooth + data istart /0/ + + +c*****initialize parameters + write (abitle,1001) + nsyn = 1 + sigma = 0. + jrotdel = 0 + fsmooth = 'no_filename_given' + + +c*****on entering, rewind the unsmoothed and smoothed spectrum output +c files, and get the synthesis range parameters from the 'dump' file + rewind nf2out + rewind nf3out +55 read (nf2out,1002) moditle + if (moditle(1:15).eq.' element' .or. + . moditle(1:15).eq.' ALL abundances' .or. + . moditle(1:15).eq.'Isotope Ratio: ') go to 55 + read (nf2out,*) start, sstop, step + kount = nint((sstop - start + (step/4.0) )/step) + 1 + rewind nf2out + + +c*****the first time through, read in the Gaussian FWHM array + if (istart .eq. 0) then + istart = 1 + nfsmooth = 35 + array = 'SMOOTHING FWHM DATA' + nchars = 19 + call infile ('input ',nfsmooth,'formatted ',0,nchars, + . fsmooth,line) + j = 1 +39 read (nfsmooth,*,end=40) wavefwhm(j), fwhm(j) + j = j + 1 + if (j .le. 100) then + go to 39 + else + istat = ivcleof (line,1) + istat = ivmove (line-1,1) + write (*,*) 'ERROR: TOO MANY POINTS IN THE FWHM FILE!' + smtype = 'e' + return + endif +40 jtotfwhm = j - 1 + endif + + +c*****now read in the raw spectrum and flip to a depth scale +45 noff = 80*(nsyn-1) + abitle(noff+1:noff+12) = '[M/H] 0.00 ' + nabunds = 0 +41 read (nf2out,1002,end=2000) array + if (array(1:15).eq.' ALL abundances') then + abitle(noff+6:noff+10) = array(56:60) + go to 41 + elseif (array(1:15).eq.' element') then + nabunds = nabunds + 1 + if (nabunds .le. 7) then + ioff = noff + 12 + 9*(nabunds-1) + abitle(ioff+1:ioff+2) = array(17:18) + abitle(ioff+3:ioff+7) = array(34:38) + abitle(ioff+8:ioff+9) = ' ' + endif + go to 41 + elseif (array(1:15).eq.'Isotope Ratio: ') then + nabunds = nabunds + 1 + if (nabunds .le. 7) then + ioff = noff + 12 + 9*(nabunds-1) + abitle(ioff+1:ioff+4) = array(27:30) + abitle(ioff+5:ioff+5) = ' ' + do k=33,44 + if (array(k:k) .ne. ' ') then + abitle(ioff+6:ioff+8) = array(k:k+2) + go to 60 + endif + enddo +60 abitle(ioff+9:ioff+9) = ' ' + endif + go to 41 + endif + read (nf2out,1002,end=2000) + read (nf2out,1003,end=2000) (y(i),i=1,kount) + do i=1,kount + y(i) = 1.0 - y(i) + enddo + + +c*****go through the spectrum wavelengths step by step; the +c Gaussian smoothing will need to be different at each step + i = 0 + oldhalf = 0. +25 i = i + 1 + if (i .gt. kount) go to 90 + synstep = start + (i-1)*step + + +c*****interpolate linearly in the FWHM array to get the appropriate value +c for the current wavelength step + if (synstep .le. wavefwhm(1)) then + half = fwhm(1) + elseif (synstep .ge. wavefwhm(jtotfwhm)) then + half = fwhm(jtotfwhm) + else + do j=2,jtotfwhm + if (synstep .le. wavefwhm(j)) then + half = fwhm(j-1) + (synstep-wavefwhm(j-1))* + . (fwhm(j)-fwhm(j-1))/(wavefwhm(j)-wavefwhm(j-1)) + if (half .gt. 0.) then + go to 10 + else + go to 15 + endif + endif + enddo + endif + + +c*****compute the Gaussian smoothing function, if needed +10 if (dabs(half-oldhalf)/half .lt. 0.03) go to 50 + oldhalf = half + sigma = half/2 + aa = 0.6932/sigma**2 + power = 1.0 + do k=1,1000 + p(k) = dexp(-aa*(step*k)**2 ) + power = power + 2*p(k) + if (p(k) .lt. 0.05) then + jdel = k + min = jdel + 1 + max = kount - jdel + p0 = 1. + go to 50 + endif + enddo + istat = ivcleof (line,1) + istat = ivmove (line-1,1) + write (*,1023) sigma, (p(i),i=1,1000) + smtype = 'e' + return + + +c*****if no smoothing, just equate the smoothed to the unsmoothed point +15 z(i) = y(i) + go to 25 + + +c*****otherwise smooth the spectrum +50 if (i.lt.min .or. i.gt.max) then + z(i) = y(i) + else + z(i) = p0*y(i) + do k=1,jdel + z(i) = z(i) + p(k)*(y(i-k) + y(i+k)) + enddo + z(i) = z(i)/power + endif + go to 25 + + +c*****copy the smoothed spectrum to the appropriate array +90 do i=1,kount + chunk(i,nsyn) = z(i) + enddo + + +c*****compute the wavelength array; must be done for each synthetic +c spectrum because of the way the equivalences were set up + do i=1,kount + xsyn(i) = start + (i-1)*step + end do + + +c*****dump the smoothed spectrum in a MONGO-style set of +c (wavelength,flux) point pairs + write (nf3out,1005) kount, start, sstop, step + if (xsyn(1) .le. 100.0) then + write (nf3out,1009) (xsyn(i),z(i),i=1,kount) + else + write (nf3out,1008) (xsyn(i),z(i),i=1,kount) + endif + nsyn = nsyn + 1 + go to 45 + + +c*****exit the routine normally +2000 nsyn = nsyn - 1 + return + + +c*****format statements +1001 format (400(' ')) +1002 format (a80) +1003 format (10f7.4) +1005 format ('the number of points per synthesis = ',i5/ + . 'start = ',f10.3,5x,'stop = ',f10.3,5x,'step = ',f10.3) +1008 format (f10.3,' ',f10.5) +1009 format (f10.6,' ',f10.5) +1023 format ('ERROR: GAUSSIAN PROFILE TOO BIG! (HALF WIDTH=', + . f6.2,') THE PROFILE:'/(15f5.2)) + + end + + + diff --git a/Vmacro.f b/Vmacro.f new file mode 100755 index 0000000..20e745f --- /dev/null +++ b/Vmacro.f @@ -0,0 +1,102 @@ + + real*8 function vmacro (xprofile) +c****************************************************************************** +c This routine computes, by linear interpolation, a point along a +c radial-tangential macroturbulence profile. This routine was written by +c Suchitra Balachandran, and is based on the work of Gray 1992, in +c "The Obs. & Anal. of Stell. Phot", p. 409. These functions have +c been computed and included in the data arrays below: +c xrt = velocity / zeta_RT +c yrt = value at xrt +c The area under the function is normalized to unity +c****************************************************************************** + + implicit real*8 (a-h,o-z) + real*8 xrt(250), yrt(250) +c + data (xrt(l),l=1,171)/ + . 0.0001,0.0101,0.0201,0.0301,0.0401,0.0501,0.0601,0.0701,0.0801, + . 0.0901,0.1001,0.1101,0.1201,0.1301,0.1401,0.1501,0.1601,0.1701, + . 0.1801,0.1901,0.2001,0.2101,0.2201,0.2301,0.2401,0.2501,0.2601, + . 0.2701,0.2801,0.2901,0.3001,0.3101,0.3201,0.3301,0.3401,0.3501, + . 0.3601,0.3701,0.3801,0.3901,0.4001,0.4101,0.4201,0.4301,0.4401, + . 0.4501,0.4601,0.4701,0.4801,0.4901,0.5001,0.5101,0.5201,0.5301, + . 0.5401,0.5501,0.5601,0.5701,0.5801,0.5901,0.6001,0.6101,0.6201, + . 0.6301,0.6401,0.6501,0.6601,0.6701,0.6801,0.6901,0.7001,0.7101, + . 0.7201,0.7301,0.7401,0.7501,0.7601,0.7701,0.7801,0.7901,0.8001, + . 0.8101,0.8201,0.8301,0.8401,0.8501,0.8601,0.8701,0.8801,0.8901, + . 0.9001,0.9101,0.9201,0.9301,0.9401,0.9501,0.9601,0.9701,0.9801, + . 0.9901,1.0001,1.0101,1.0201,1.0301,1.0401,1.0501,1.0601,1.0701, + . 1.0801,1.0901,1.1001,1.1101,1.1201,1.1301,1.1401,1.1501,1.1601, + . 1.1701,1.1801,1.1901,1.2001,1.2101,1.2201,1.2301,1.2401,1.2501, + . 1.2601,1.2701,1.2801,1.2901,1.3001,1.3101,1.3201,1.3301,1.3401, + . 1.3501,1.3601,1.3701,1.3801,1.3901,1.4001,1.4101,1.4201,1.4301, + . 1.4401,1.4501,1.4601,1.4701,1.4801,1.4901,1.5001,1.5101,1.5201, + . 1.5301,1.5401,1.5501,1.5601,1.5701,1.5801,1.5901,1.6001,1.6101, + . 1.6201,1.6301,1.6401,1.6501,1.6601,1.6701,1.6801,1.6901,1.7001/ + data (xrt(l),l=172,250)/ + . 1.7101,1.7201,1.7301,1.7401,1.7501,1.7601,1.7701,1.7801,1.7901, + . 1.8001,1.8101,1.8201,1.8301,1.8401,1.8501,1.8601,1.8701,1.8801, + . 1.8901,1.9001,1.9101,1.9201,1.9301,1.9401,1.9501,1.9601,1.9701, + . 1.9801,1.9901,2.0001,2.0101,2.0201,2.0301,2.0401,2.0501,2.0601, + . 2.0701,2.0801,2.0901,2.1001,2.1101,2.1201,2.1301,2.1401,2.1501, + . 2.1601,2.1701,2.1801,2.1901,2.2001,2.2101,2.2201,2.2301,2.2401, + . 2.2501,2.2601,2.2701,2.2801,2.2901,2.3001,2.3101,2.3201,2.3301, + . 2.3401,2.3501,2.3601,2.3701,2.3801,2.3901,2.4001,2.4101,2.4201, + . 2.4301,2.4401,2.4501,2.4601,2.4701,2.4801,2.4901/ +c + data (yrt(l),l=1,133)/ + . 1.128380,1.126790,1.088790,1.069200,1.049990,1.031020,1.012720, + . 0.993719,0.975411,0.957327,0.939467,0.921830,0.904416,0.887224, + . 0.870264,0.853520,0.836978,0.820671,0.805960,0.788712,0.773060, + . 0.757624,0.742405,0.727394,0.712603,0.698026,0.683659,0.669504, + . 0.655559,0.641822,0.628292,0.614969,0.601851,0.588936,0.576224, + . 0.563713,0.551402,0.539288,0.527372,0.515651,0.504123,0.492788, + . 0.481644,0.470689,0.459921,0.449339,0.438813,0.428727,0.418693, + . 0.408839,0.399161,0.389660,0.382276,0.371177,0.362193,0.353376, + . 0.344727,0.336242,0.327921,0.319760,0.311759,0.303916,0.296228, + . 0.288693,0.281342,0.273786,0.266697,0.260087,0.253292,0.246640, + . 0.240128,0.233754,0.227516,0.221413,0.215442,0.209602,0.203891, + . 0.198305,0.192845,0.187508,0.182291,0.177193,0.172213,0.167347, + . 0.162595,0.157955,0.153423,0.149000,0.144683,0.140469,0.136358, + . 0.132347,0.128434,0.124619,0.120898,0.117271,0.113735,0.110289, + . 0.106931,0.103659,0.100472,0.097368,0.094346,0.091403,0.088538, + . 0.085750,0.083037,0.080397,0.077829,0.075331,0.072902,0.070540, + . 0.068244,0.066012,0.063844,0.061736,0.059689,0.057701,0.055770, + . 0.053895,0.052075,0.050308,0.048594,0.046930,0.045317,0.043751, + . 0.042233,0.040761,0.039334,0.037951,0.036611,0.035316,0.034058/ + data (yrt(l),l=134,250)/ + . 0.032839,0.031659,0.030516,0.029410,0.028339,0.027303,0.026300, + . 0.025330,0.024392,0.023484,0.022607,0.021759,0.020939,0.020147, + . 0.019382,0.018643,0.017928,0.017239,0.016573,0.015930,0.015309, + . 0.014711,0.014133,0.013576,0.013038,0.012520,0.012021,0.011539, + . 0.011075,0.010627,0.010196,0.009781,0.009381,0.008996,0.008626, + . 0.008269,0.007925,0.007595,0.007277,0.006972,0.006678,0.006395, + . 0.006123,0.005862,0.005611,0.005369,0.005138,0.004915,0.004701, + . 0.004496,0.004299,0.004110,0.003929,0.003755,0.003588,0.003428, + . 0.003274,0.003127,0.002986,0.002850,0.002721,0.002597,0.002478, + . 0.002364,0.002255,0.002151,0.002051,0.001955,0.001864,0.001776, + . 0.001692,0.001612,0.001536,0.001463,0.001393,0.001326,0.001262, + . 0.001201,0.001143,0.001087,0.001034,0.000984,0.000935,0.000889, + . 0.000845,0.000803,0.000763,0.000725,0.000689,0.000654,0.000621, + . 0.000590,0.000560,0.000531,0.000504,0.000478,0.000454,0.000430, + . 0.000408,0.000387,0.000366,0.000347,0.000329,0.000312,0.000295, + . 0.000280,0.000265,0.000251,0.000237,0.000224,0.000212,0.000201, + . 0.000190,0.000180,0.000170,0.000161,0.000152/ + + + if (xprofile.lt.xrt(1) .or. xprofile.ge.xrt(250)) then + vmacro = 0. + return + endif + + i = nint(100.*xprofile) + 1 + vmacro = (yrt(i+1)-yrt(i))*(xprofile-xrt(i))/(xrt(i+1)-xrt(i)) + . + yrt(i) + + + return + end + + + @@ -0,0 +1,70 @@ + + real*8 function voigt(a,v) +c****************************************************************************** +c This routine calculates the voigt function using the approximations +c found in the *new series-astronomy and astrophysics* volume of +c landolt-bornstein. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + a2 = a*a + v2 = v*v + if(a .eq. 0.) go to 62 + if(a .le. 0.2) go to 50 + if(a.le.1.4 .and. a+v.le.3.2) go to 30 + + +c case 1, a .gt. 1.4 or (a .gt. 0.2 and a+v .gt. 3.2) + u = 1.4142136*(a2 + v2) + voigt = 0.7978847*a/u*(1.0 + (3.0*v2-a2)/u**2 + (15.0*v2*v2 + 1 -30.0*a2*v2+3.0*a2*a2)/u**4) + voigt = voigt/1.772454 + return +30 u=0.979895023-0.962846325*a+0.532770573*a2-0.122727278*a*a2 +31 h0 = dexp(-v2) + if(v .ge. 2.4) go to 35 + if(v .ge. 1.3) go to 33 + + +c case 2, 0.2 .lt. a .le. 1.4 and a+v .le. 3.2 + h1=-1.12470432-0.15516677*v+3.28867591*v2-2.34357915*v*v2 + 1 +0.42139162*v2*v2 + go to 36 +33 h1=-4.48480194+9.39456063*v-6.61487486*v2+1.98919585*v*v2 + 1 -0.2204165*v2*v2 + go to 36 +35 h1=(0.554153432+0.278711796*v-0.188325687*v2+0.042991293*v*v2 + 1 -0.003278278*v2*v2)/(v2 - 1.5) +36 h2 = (1.0 - 2.0*v2)*h0 + if(a .le. 0.2) go to 52 + h1 = h1 + 1.1283790*h0 + h2p = h2 + h2 = h2 - h0 + 1.1283790*h1 + h3 = 0.37612635*(1.0-h2p) - 0.6666667*v2*h1 + 1.1283790*h2 + h4 = 0.6666667*v2*v2*h0 - 0.37612635*h1 + 1.1283790*h3 + voigt = u*(h0 + h1*a + h2*a2 + h3*a*a2 + h4*a2*a2) + voigt = voigt/1.772454 + return + + +c case 3, a .le. 0.2 and v .lt. 5.0 +50 if(v .ge. 5.0) go to 60 + go to 31 +52 voigt = h0 + h1*a + h2*a2 + voigt = voigt/1.772454 + return + + +c case 4, a .le. 0.2 and v .ge. 5.0 +60 voigt = a/(1.772454*v2)*(1.0 + 1.5/v2 + 3.75/(v2*v2)) + voigt = voigt/1.772454 + return + + +c case 5, a .eq. 0.0 +62 voigt = exp(-v2)/1.772454 + + + return + end + diff --git a/Wavecalc.f b/Wavecalc.f new file mode 100755 index 0000000..238eaf7 --- /dev/null +++ b/Wavecalc.f @@ -0,0 +1,59 @@ + + real*8 function wavecalc(point,npt,c) +c****************************************************************************** +c this routine returns the wavelength of a given channel number +c****************************************************************************** + + implicit real*8 (a-h,o-z) + real*4 point + real*8 c(9) + + if (c(9) .eq. 1.) go to 20 + if (c(9) .eq. 2.) go to 40 + if (c(9) .eq. 3.) go to 30 + +c*****no wavelength solution exists + if (c(1).eq.0. .or. c(2).eq.0.) then + wavecalc = point + +c*****an ordinary polynomial solution + else + dn = point + wavecalc = c(1)+dn*(c(2)+dn*(c(3)+dn*(c(4)+ + . dn*(c(5)+dn*c(6))))) + endif + return + +c*****a Chebyshev polynomial solution +20 xpt = (2.*point-real(npt+1))/real(npt-1) + wavecalc = c(1) + + . c(2)*xpt + + . c(3)*(2.*xpt**2-1.) + + . c(4)*xpt*(4.*xpt**2-3.) + + . c(5)*(8.*xpt**4-8.*xpt**2+1.) + + . c(6)*xpt*(16.*xpt**4-20.*xpt**2+5.) + return + +c*****a spline3 solution +30 s = (point-1.)/(real(npt)-1.)*c(8) + j = int(s) + a = real(j+1) - s + b = s - real(j) + z0 = a**3 + z1 = 1. + 3.*a*(1.+a*b) + z2 = 1. + 3.*b*(1.+a*b) + z3 = b**3 + wavecalc = c(j+1)*z0 + c(j+2)*z1 + c(j+3)*z2 + c(j+4)*z3 + return + +c*****a Legendre polynomial solution +40 xpt = (2.*point-real(npt+1))/real(npt-1) + wavecalc = c(1) + c(2)*xpt + return + + + end + + + + diff --git a/Weedout.f b/Weedout.f new file mode 100755 index 0000000..5102819 --- /dev/null +++ b/Weedout.f @@ -0,0 +1,165 @@ + + subroutine weedout +c****************************************************************************** +c This routine goes through an initial line list and culls from it +c absorption lines that are not substantial contributors. This is +c done in a simple fashion by eliminating lines weaker than X, where +c X = kapnu/kaplam at the approximate line wavelength, calculated +c at a continuue optical depth of 0.5. The user will be prompted for +c the desired value of X. +c****************************************************************************** + + implicit real*8 (a-h,o-z) + include 'Atmos.com' + include 'Linex.com' + include 'Pstuff.com' + real*8 xratio + real*4 shortnum + + +c*****examine the parameter file + call params + + +c*****open the files for: standard output, lines to be kept, and lines +c to be heaved out + nf1out = 20 + lscreen = 4 + array = 'STANDARD OUTPUT' + nchars = 15 + call infile ('output ',nf1out,'formatted ',0,nchars, + . f1out,lscreen) + nf8out = 21 + lscreen = lscreen + 2 + array = 'KEPT LINES' + nchars = 10 + call infile ('output ',nf8out,'formatted ',0,nchars, + . f8out,lscreen) + nf9out = 22 + lscreen = lscreen + 2 + array = 'DISCARDED LINES' + nchars = 15 + call infile ('output ',nf9out,'formatted ',0,nchars, + . f9out,lscreen) + + +c*****open and read the model atmosphere file + nfmodel = 30 + lscreen = lscreen + 2 + array = 'THE MODEL ATMOSPHERE' + nchars = 20 + call infile ('input ',nfmodel,'formatted ',0,nchars, + . fmodel,lscreen) + call inmodel + call eqlib + + +c*****open the initial line list file + nflines = 31 + lscreen = lscreen + 2 + array = 'THE INITIAL LINE LIST' + nchars = 21 + call infile ('input ',nflines,'formatted ',0,nchars, + . flines,lscreen) + +c*****ask the user about the value of X + lscreen = lscreen + 2 + array = 'GIVE THE MINIMUM LINE/CONTINUUM OPACITY RATIO TO KEEP: ' + nchars = 55 + call getnum (nchars,lscreen,xratio,shortnum) + write (nf1out,1001) xratio + write (nf8out,1002) + write (nf9out,1003) + + +c*****compute the line opacities + call inlines (3) +1 call nearly (1) + + +c*****calculate continuum quantities at the line list wavelength middle + wave = (wave1(1)+wave1(nlines))/2. + call opacit (2,wave) + if (modprintopt .ge. 2) + . write(nf1out,1006) wave,(kaplam(i),i=1,ntau) + + +c*****divide the lines into keepers and discards + do j=1,nlines + residual = 10.*atom1(j) - dble(nint(10.*(atom1(j)))) + if (strength(j)/kaplam(jtau5) .ge. xratio) then + if (atom1(j) .lt. 100.) then + if (residual .gt. 0. .and. dampnum(j) .gt. 0.) then + write (nf8out,1007) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), dlog10(dampnum(j)), dlog10(strength(j)) + else if (residual .gt. 0. .and. dampnum(j) .le. 0.) then + write (nf8out,1007) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), 0.0, dlog10(strength(j)) + else if (residual .le. 0. .and. dampnum(j) .gt. 0.) then + write (nf8out,1004) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), dlog10(dampnum(j)), dlog10(strength(j)) + else + write (nf8out,1004) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), 0.0, dlog10(strength(j)) + endif + else + if (residual .gt. 0.) then + write (nf8out, 1008) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), d0(j), dlog10(strength(j)) + else + write (nf8out, 1005) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), d0(j), dlog10(strength(j)) + endif + endif + else + if (atom1(j) .lt. 100.) then + if (residual .gt. 0. .and. dampnum(j) .gt. 0.) then + write (nf9out,1007) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), dlog10(dampnum(j)), dlog10(strength(j)) + else if (residual .gt. 0. .and. dampnum(j) .le. 0.) then + write (nf9out,1007) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), 0.0, dlog10(strength(j)) + else if (residual .le. 0. .and. dampnum(j) .gt. 0.) then + write (nf9out,1004) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), dlog10(dampnum(j)), dlog10(strength(j)) + else + write (nf9out,1004) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), 0.0, dlog10(strength(j)) + endif + else + if (residual .gt. 0.) then + write (nf9out, 1008) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), d0(j), dlog10(strength(j)) + else + write (nf9out, 1005) wave1(j), atom1(j), e(j,1), + . dlog10(gf(j)), d0(j), dlog10(strength(j)) + endif + endif + endif + enddo + if (nlines +nstrong .eq. 2500) then + call inlines (6) + go to 1 + endif + + +c*****finish + call finish (0) + + +c*****format statements +1001 format (/'DESIRED LINE-TO-CONTINUUM MINIMUM OPACITY RATIO: ', + . 1pe10.2) +1002 format ('THIS IS THE KEEPER LINE LIST') +1003 format ('THIS IS THE DISCARDED LINE LIST') +1004 format (f10.4, f10.1, f10.3, f10.3, f10.3, 20x, f9.1) +1005 format (f10.4, f10.1, f10.3, f10.3, 10x, f10.3, 10x, f9.1) +1006 format (' kaplam from 1 to ntau at wavelength',f10.2/ + . (6(1pd12.4))) +1007 format (f10.4, f10.4, f10.3, f10.3, f10.3, 20x, f9.1) +1008 format (f10.4, f10.5, f10.3, f10.3, 10x, f10.3, 10x, f9.1) + + + end + + diff --git a/Writenumber.f b/Writenumber.f new file mode 100755 index 0000000..9ff3a30 --- /dev/null +++ b/Writenumber.f @@ -0,0 +1,35 @@ + + subroutine writenumber (xnum) +c****************************************************************************** +c This subroutine decides on the order-of-magnitude of a number and +c writes it to a character string in a reasonable format +c****************************************************************************** + + include 'Pstuff.com' + real*4 xnum, lognum + integer numdec + + + lognum = alog10(abs(xnum)) + if (lognum .ge. 6.) then + write (errmess,1002) + elseif (lognum .ge. 0.) then + numdec = 5 - nint(lognum) + write (errmess,1001) numdec + else + write (errmess,1003) + endif + write (array,errmess) xnum + return + + +c*****format statements +1001 format ('(f8.',i1,'$)') +1002 format ('(1pe8.1$)') +1003 format ('(f8.5$)') + + + end + + + |