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PROGRAM RNLTE
C THIS PROGRAM MUST BE RUN IMMEDIATELY AFTER SYNBEG IF IT IS USED
C READS NLTE LINES FROM UNIT 11 AS CARD IMAGES AND WRITES THEM ON
C UNIT 19. IF IFNLTE=0 UNIT 19 IS READ BY SYNTHE AND THE LINES ARE
C TREATED IN LTE. IF IFNLTE=1 UNIT 19 IS READ BY SPECTR AND THE
C LINES ARE TREATED IN NLTE IF THE MODEL IS NLTE.
C THESE LINES ARE TREATED WITH EXACT VOIGT OR FANO PROFILES
C WL IS THE AIR WAVELENGTH IF WL .GT. 200 NM
C IF THE SWITCH IFVAC=1 THE WAVELENGTH USED BY THE PROGRAM WILL
C BE THE VACUUM WAVELENGTH OBTAINED FROM THE DIFFERENCE OF
C THE ENERGY LEVELS
C A SUFFIX P STANDS FOR PRIME INDICATING THE SECOND CONFIGURATION
C J IS ANGULAR MOMENTUM
C E IS ENERGY IN WAVENUMBERS
C LABEL IS A LABEL FOR THE CONFIGURATION
C THE GF TAPE DOES NOT KEEP LABEL AND LABELP DISTINCT
C CODE FOR ATOM OR MOLECULE
C NELION IS THE STORAGE LOCATION OF ELEM IN ARRAYS XNFPEL AND DOPPLE
C GAMMAR IS THE RADIATIVE DAMPING CONSTANT
C GAMMAW IS THE DAMPING CONSTANT PER HYDROGEN ATOM FOR VAN DER WAALS
C BROADENING BY HYDROGEN AT T=10000K.
C FOR HELIUM MULTIPLY BY .42
C FOR H2 MULTIPLY BY .85
C GAMMAS IS THE STARK DAMPING CONSTANT PER ELECTRON ASSUMED TO BE
C TEMPERATURE INDEPENDENT
C TO CONVERT GRIEM"S HALF WIDTH TO GAMMAS FOR DLAM AND LAM IN A
C GAMMAS=3767.*DLAM/LAM**2
C LOG(GAMMA) IS READ IN
C IF NOT READ IN GAMMAR IS CLASSICAL, GAMMAW IS FROM ALLER, AND
C GAMMAS IS FROM PEYTREMANN
C REF ARE A REFERENCE OR REFERENCES FOR GF AND DAMPING CONSTANTS
C NBLO AND NBUP REFER TO DEPARTURE COEFFICIENT ARRAYS FOR THE LOWER
C AND UPPER LEVELS (NOT FIRST AND SECOND)
C ISO1 AND ISO2 ARE ISOTOPE NUMBERS FOR UP TO 2 COMPONENTS
C X1 AND X2 ARE LOG FRACTIONAL ISOTOPIC ABUNDANCES THAT ARE ADDED TO
C LOG GF TO OBTAIN AN ISOTOPIC ABUNDANCE
C OTHER1 AND 2 ARE ADDITIONAL LABEL FIELDS OR QUANTUM NUMBERS OR
C WHATEVER
C OTHER1 IS NOW USED TO STORE LANDE G VALUES AS 2 I5 INTEGERS IN UNITS
C OF .001 . EXAMPLE GLANDE=-.007 GLANDEP=2.499 OTHER1= -7 2499
C DWL CORRECTION TO WL
C DLOGGF CORRECTION TO LOGGF
C DGAMMAR LOG CORRECTION TO GAMMAR
C DGAMMAS LOG CORRECTION TO GAMMAS
C DGAMMAW LOG CORRECTION TO GAMMAW
C DWLISO IS ISOTOPE SHIFT
CC SAMPLE CARDS
C 396.8470 -0.162 0.5 0.000 1.5 25191.541 20.01 4S 4P
C 396.8470 116 8.24 -4.44 -7.80 REF
COMMON /LINDAT/WL,E,EP,LABEL(2),LABELP(2),OTHER1(2),OTHER2(2),
1 WLVAC,CENTER,CONCEN, NELION,GAMMAR,GAMMAS,GAMMAW,REF,
2 NBLO,NBUP,ISO1,X1,ISO2,X2,GFLOG,XJ,XJP,CODE,ELO,GF,GS,GR,GW,
3 DWL,DGFLOG,DGAMMAR,DGAMMAS,DGAMMAW,DWLISO,EXTRA2,EXTRA3
REAL*8 LINDAT8(14)
REAL*4 LINDAT(28)
EQUIVALENCE (LINDAT8(1),WL),(LINDAT(1),NELION)
REAL*8 RESOLU,RATIO,RATIOLG,SIGMA2,WLBEG,WLEND
REAL*8 WL,E,EP,WLVAC,CENTER,CONCEN
REAL*8 LABEL,LABELP,OTHER1,OTHER2
INTEGER TYPE
EQUIVALENCE (GAMMAS,ASHORE),(GAMMAW,BSHORE)
EQUIVALENCE (GF,G,CGF),(TYPE,NLAST),(GAMMAR,XSECT,GAUNT)
COMMON /POTION/POTION(594)
DIMENSION CODEX(17),NEWNELION(17)
DIMENSION DELLIM(7)
DATA NEWNELION/1,3,4,21,22,78,79,91,92,105,106,210,211,
1 36,66,15,190/
DATA CODEX/1.,2.,2.01,6.,6.01,12.,12.01,13.,13.01,14.,14.01,
1 20.,20.01,8.,11.,5.,19./
DATA DELLIM/100.,30.,10.,3.,1.,.3,.1/
RATIOLG=LOG(1.D0+1.D0/2000000.D0)
OPEN(UNIT=11,STATUS='OLD',READONLY,SHARED)
WLVACOLD=0.
DO 900 ILINE=1,1000000
READ(11,140,END=145)
1WL,GFLOG,XJ,E,XJP,EP,CODE,LABEL,LABELP,DWLISO,WL,NELION,
2GAMMAR,GAMMAS,GAMMAW,REF,NBLO,NBUP,ISO1,X1,ISO2,X2,OTHER1,
3OTHER2,DWL,DGFLOG,DGAMMAR,DGAMMAS,DGAMMAW,NOTES
140 FORMAT(F10.4,F7.3,F5.1,F12.3,F5.1,F12.3,F9.2,A8,A2,A8,A2,F7.4/
1F10.4,I4,F6.2,F6.2,F6.2,A4,I2,I2,I3,F7.3,I3,F7.3,A8,A2,A8,A2,
2F7.4,F7.3,3F6.2,A20)
WLVAC=1.E7/DABS(DABS(EP)-DABS(E))
IF(WLVAC.LT.WLVACOLD)THEN
PRINT *,WL,WLVAC,WLVACOLD
CALL EXIT
ENDIF
NBUFF=DLOG(WLVAC)/RATIOLG
DECODE(10,143,OTHER2)O2,AUTO,NKP
143 FORMAT(A1,A3,I6)
LIM=7
C IF(O2.EQ.1H )LIM=7
C IF(O2.EQ.1H0)LIM=7
C IF(O2.EQ.1H1)LIM=7
IF(O2.EQ.1H2)LIM=6
IF(O2.EQ.1H3)LIM=5
IF(O2.EQ.1H4)LIM=4
IF(O2.EQ.1H5)LIM=3
IF(O2.EQ.1H6)LIM=2
IF(O2.EQ.1H7)LIM=1
IF(CODE.NE.1.00)GO TO 1201
C LIM=6
C IF(NBUP.LT.30)LIM=5
LIM=5
IF(NBUP.LT.22)LIM=4
IF(NBUP.LT.12)LIM=3
IF(NBUP.LT.7)LIM=2
IF(LABELP(1).EQ.8HCONT )LIM=2
1201 CONTINUE
IF(AUTO.EQ.3HCOR)GO TO 900
C WRITE(6,144)WL,GFLOG,XJ,E,XJP,EP,CODE,LABEL,LABELP,WL,NELION,
C 1GAMMAR,GAMMAS,GAMMAW,REF,NBLO,NBUP,ISO1,X1,ISO2,X2,OTHER1,OTHER2
C 144 FORMAT(F11.4,F7.3,F5.1,F12.3,F5.1,F12.3,F9.2,A8,A2,A8,A2/
C 1F11.4,I4,F6.2,F6.2,F6.2,A4,I2,I2,I3,F7.3,I3,F7.3,A8,A2,A8,A2)
C IF(NKP.GT.0)NDELET(NKP/10+1)=NDELET(NKP/10+1)+NTENS(MOD(NKP,10)+1)
GR=GAMMAR
GS=GAMMAS
GW=GAMMAW
GF=EXP((GFLOG+DGFLOG+X1+X2)*2.30258509299405E0)
ELO=DMIN1(DABS(E),DABS(EP))
GAMMAR=EXP((GAMMAR+DGAMMAR)*2.30258509299405E0)
GAMMAS=EXP((GAMMAS+DGAMMAS)*2.30258509299405E0)
GAMMAW=EXP((GAMMAW+DGAMMAW)*2.30258509299405E0)
IF(GAMMAR.EQ.1)THEN
GAMMAR=2.223E13/WLVAC**2
GR=ALOG10(GAMMAR)
ENDIF
IF(GAMMAS.NE.1..AND.GAMMAW.NE.1.)GO TO 141
IF(GAMMAS.NE.1.)GO TO 138
IF(CODE.GE.100.)GO TO 137
EUP=DMAX1(DABS(E),DABS(EP))
ZEFF=(CODE-FLOAT(IFIX(CODE)))*100.+1.
EFFNSQ=25.
DELEUP=POTION(NELION)-EUP
IF(DELEUP.GT.0.)EFFNSQ=109737.31*ZEFF**2/DELEUP
GAMMAS=1.0E-8*EFFNSQ**2*SQRT(EFFNSQ)
GS=ALOG10(GAMMAS)
GO TO 138
137 GAMMAS=1.0E-5
GS=-5.
138 IF(GAMMAW.NE.1.)GO TO 141
IF(CODE.GE.100.)GO TO 139
EUP=DMAX1(DABS(E),DABS(EP))
ZEFF=(CODE-FLOAT(IFIX(CODE)))*100.+1.
EFFNSQ=25.
DELEUP=POTION(NELION)-EUP
IF(DELEUP.GT.0.)EFFNSQ=109737.31*ZEFF**2/DELEUP
C EFFNSQ=AMIN1(EFFNSQ,100.)
EFFNSQ=AMIN1(EFFNSQ,1000.)
RSQ=2.5*(EFFNSQ/ZEFF)**2
NSEQ=CODE-ZEFF+1.
IF(NSEQ.GT.20.AND.NSEQ.LT.29)RSQ=(45.-FLOAT(NSEQ))/ZEFF
GAMMAW=4.5E-9*RSQ**.4
GW=ALOG10(GAMMAW)
GO TO 141
139 GAMMAW=1.E-7/ZEFF
GW=ALOG10(GAMMAW)
141 CONTINUE
IF(LABELP(1).EQ.8HCONT )
AWRITE(6,144)WL,GFLOG,XJ,E,XJP,EP,CODE,LABEL,LABELP,DWLISO,
1WL,NELION,GR,GS,GW,REF,NBLO,NBUP,ISO1,X1,ISO2,X2,OTHER1,OTHER2,
2DWL,DGFLOG,DGAMMAR,DGAMMAS,DGAMMAW,NOTES
144 FORMAT(F11.4,F7.3,F5.1,F12.3,F5.1,F12.3,F9.2,A8,A2,A8,A2,F7.4/
1F11.4,I4,F6.2,F6.2,F6.2,A4,I2,I2,I3,F7.3,I3,F7.3,A8,A2,A8,A2,
2F7.4,F7.3,3F6.2,A20)
C TYPE=-1 HYDROGEN LINE
C TYPE=0 NORMAL LINE
C TYPE=1 AUTOIONIZING LINE
C TYPE=2 CORONAL APPROXIMATION LINE
C TYPE=3 PRD LINE
C TYPE.GT.3 = NLAST CONTINUUM
TYPE=0
IF(CODE.EQ.1.00)TYPE=-1
IF(AUTO.EQ.3HCOR)TYPE=2
IF(AUTO.EQ.3HAUT)TYPE=1
IF(AUTO.EQ.3HPRD)TYPE=3
IF(LABELP(1).EQ.8HCONT )NLAST=XJP
IF(LABELP(1).EQ.8HCONT )GF=GF*(XJ+XJ+1.)
NCON=0
IF(ISO1.EQ.0.AND.ISO2.GT.0)NCON=ISO2
IF(TYPE.EQ.1)GO TO 17
IF(TYPE.GT.3)GO TO 17
FRELIN=2.99792458E17/WLVAC
CGF=.026538/1.77245*GF/FRELIN
C GR IS GAUNT FACTOR FOR CORONAL LINES
IF(TYPE.EQ.2)GAMMAR=GR
IF(TYPE.EQ.2)GO TO 1253
GAMMAR=GAMMAR/12.5664/FRELIN
GAMMAS=GAMMAS/12.5664/FRELIN
GAMMAW=GAMMAW/12.5664/FRELIN
17 NBUP=IABS(NBUP)
NBLO=IABS(NBLO)
DO 1250 I=1,17
IF(CODE.EQ.CODEX(I))GO TO 1252
1250 CONTINUE
WRITE(6,1251)CODE
1251 FORMAT(9H BAD CODE,F10.2)
CALL EXIT
1252 NELIONX=I
NELION=NEWNELION(NELIONX)
1253 WRITE(19)WLVAC,ELO,GF,NBLO,NBUP,NELION,TYPE,NCON,NELIONX,
1GAMMAR,GAMMAS,GAMMAW,NBUFF,LIM
IF(LABELP(1).EQ.8HCONT )PRINT 1118,TYPE
N19=N19+1
C WRITE(6,5555)WLVAC,ILINE
C 5555 FORMAT(112X,F10.4,I10)
900 CONTINUE
145 WRITE(6,1118)N19
1118 FORMAT(I10,25H LINES WRITTEN ON TAPE 19)
CALL EXIT
END
SUBROUTINE IONPOTS
C
C Moore, C.E., NSRDS-NBS 34,1970,22pp.
C AEL, rare-earth elements, 1978,NSRDS-NBS 60,411pp.
C Kelley,R.L. and Harrison, D.E, Atomic Data 3,177-193,1971. Ga V,VI,Ge VI
C Martin,W.C. et al. ,JPCRDa,3,771-780,1974. Ac I-Es I
C Guess 55.02 56.02 73.01 73.02 74.01 74.02 75.01 75.02 76.01 76.01
C Guess 77.01 77.02 78.02 79.02 84.01 84.02 85.00 85.01 85.02 86.01 86.02
C Guess 87.00 87.01 87.02 88.02 89.02 91.01 91.02 92.01 92.02 93.01 93.02
C Guess 94.01 94.02 95.01 95.02 96.01 96.02 97.01 97.02 98.01 98.02
C Guess 99.01 99.02
C
COMMON /POTION/POTION(594)
DIMENSION POTA(114),POTB(114),POTC(114),POTD(114),POTE(114)
DIMENSION POTF(24)
EQUIVALENCE (POTION(1),POTA(1)),(POTION(115),POTB(1))
EQUIVALENCE (POTION(229),POTC(1)),(POTION(343),POTD(1))
EQUIVALENCE (POTION(457),POTE(1)),(POTION(571),POTF(1))
DATA POTA/
1 109678.764, 0. , 0. , 0. , 0. , 0. , 1
2 198310.76 , 438908.85 , 0. , 0. , 0. , 0. , 2
3 43487.150, 610079.0 , 987660.1 , 0. , 0. , 0. , 3
4 75192.07 , 146882.86 ,1241259.4 ,1756018.7, 0. , 0. , 4
5 66928.10 , 202887.4 , 305931.1 ,2092001.4,2744105.1, 0. , 5
6 90820.42 , 196664.7 , 386241.0 , 520178.4,3162395. ,3952061.4, 6
7 117225.4 , 238750.5 , 382704. , 624866. , 789537.2,4452758. , 7
8 109837.02 , 283240. , 443086. , 624383.8, 918657. ,1114008. , 8
9 140524.5 , 282058.6 , 505777. , 702830. , 921430. ,1267622. , 9
T 173929.70 , 330391.0 , 511800. , 783300. ,1018000. ,1273800. , 10
1 41449.44 , 381395. , 577800. , 797800. ,1116200. ,1388500. , 11
2 61671.02 , 121267.61 , 646410. , 881100. ,1139400. ,1504300. , 12
3 48278.37 , 151860.4 , 229445.71, 967800. ,1239800. ,1536300. , 13
4 65747.5 , 131838.4 , 270139.3 , 364093.1,1345100. ,1653900. , 14
5 84580. , 159100. , 243400. , 414312.4, 524460. ,1777900. , 15
6 83558.0 , 188200. , 280900. , 381541.4, 586200. , 710184. , 16
7 104591.0 , 192070. , 319500. , 431226. , 547000. , 782600. , 17
8 127109.9 , 222848.2 , 328600. , 482400. , 605100. , 734040. , 18
9 35009.77 , 255076. , 368800. , 491300. , 666700. , 806600. / 19
DATA POTB/
1 49305.72 , 95751.87 , 410614.1 , 541200. , 680800. , 877400. , 20
2 52750. , 103240. , 199700. , 592600. , 739300. , 896000. , 21
3 55010. , 109506. , 221735. , 348973. , 800300. , 962700. , 22
4 54400. , 118200. , 236400. , 376730. , 526100. ,1033400. , 23
5 54570. , 133060. , 249700. , 396000. , 559000. , 730400. , 24
6 59970. , 126145. , 271550. , 413000. , 584000. , 766000. , 25
7 63480. , 130524. , 247221. , 442000. , 604900. , 798500. , 26
8 63430. , 137572. , 270200. , 413800. , 641200. , 823000. , 27
9 61579. , 146541.56 , 283700. , 442800. , 609000. , 871000. , 28
T 62317.2 , 163669.2 , 297100. , 445124. , 644500. , 831000. , 29
1 75768.10 , 144892.6 , 320390. , 479100. , 666000. , 871000. , 30
2 48387.63 , 165458. , 247700. , 517600. , 726000. , 944000. , 31
3 63715. , 128521.3 , 276036. , 368701. , 753800. , 968000. , 32
4 79165. , 150290. , 228670. , 404369. , 505136. ,1028800. , 33
5 78658.22 , 170900. , 248583. , 346375. , 551000. , 658994. , 34
6 95284.8 , 175870. , 289529. , 381600. , 481600. , 714800. , 35
7 112914.5 , 196474.8 , 298020. , 423600. , 522000. , 633300. , 36
8 33690.81 , 220048. , 320000. , 424400. , 572800. , 680900. , 37
9 45932.0 , 88964.0 , 351800. , 460000. , 577700. , 732600. / 38
DATA POTC/
1 51447. , 98690. , 165500. , 498600. , 621200. , 750300. , 39
2 55145. , 105900. , 185400. , 276970. , 657600. , 0. , 40
3 55511. , 115500. , 202000. , 308600. , 407700. , 827300. , 41
4 57260. , 130300. , 219100. , 374180. , 493360. , 549000. , 42
5 58700. , 123100. , 238300. , 0. , 0. , 0. , 43
6 59410. , 135200. , 229600. , 0. , 0. , 0. , 44
7 60197. , 145800. , 250500. , 0. , 0. , 0. , 45
8 67236. , 156700. , 265600. , 0. , 0. , 0. , 46
9 61106.50 , 173300. , 280900. , 0. , 0. , 0. , 47
T 72538.8 , 136374.74 , 302300. , 0. , 0. , 0. , 48
1 46670.11 , 152195. , 226100. , 439000. , 0. , 0. , 49
2 59231.8 , 118017.0 , 246020.0 , 328550. , 583000. , 0. , 50
3 69700. , 133327.5 , 204248. , 356156. , 449300. , 868000. , 51
4 72667. , 150000. , 225500. , 301776. , 473900. , 570000. , 52
5 84295.1 , 154304. , 266000. , 0. , 0. , 0. , 53
6 97834.0 , 171068.4 , 259089. , 0. , 0. , 0. , 54
7 31406.432, 202263. , 280000. , 0. , 0. , 0. , 55
8 42035.14 , 80686.87 , 300000. , 0. , 0. , 0. , 56
9 44981. , 89200. , 154675. , 402900. , 497000. , 0. / 57
DATA POTD/
1 44672. , 87500. , 162903. , 296470. , 528700. , 626000. , 58
2 44070. , 85100. , 174407. , 314400. , 464000. , 0. , 59
3 44562. , 86500. , 178600. , 326000. , 0. , 0. , 60
4 44800. , 87900. , 180000. , 331000. , 0. , 0. , 61
5 45519. , 89300. , 189000. , 334000. , 0. , 0. , 62
6 45734.9 , 90665. , 201000. , 344000. , 0. , 0. , 63
7 49603. , 97500. , 166400. , 355000. , 0. , 0. , 64
8 47295. , 92900. , 176700. , 317500. , 0. , 0. , 65
9 47900. , 94100. , 183800. , 334000. , 0. , 0. , 66
T 48567. , 95200. , 184200. , 343000. , 0. , 0. , 67
1 49262. , 96200. , 183400. , 344000. , 0. , 0. , 68
2 49879.8 , 97200. , 191000. , 344000. , 0. , 0. , 69
3 50441.0 , 98269. , 202070. , 351300. , 0. , 0. , 70
4 43762.39 , 112000. , 169049. , 364960. , 538700. , 0. , 71
5 56600. , 120000. , 187800. , 268500. , 0. , 0. , 72
6 63600. , 131000. , 194000. , 0. , 0. , 0. , 73
7 64400. , 143000. , 202000. , 0. , 0. , 0. , 74
8 63530. , 134000. , 210000. , 0. , 0. , 0. , 75
9 70450. , 137000. , 218000. , 0. , 0. , 0. / 76
DATA POTE/
1 73000. , 161000. , 226000. , 0. , 0. , 0. , 77
2 72300. , 149723. , 234000. , 0. , 0. , 0. , 78
3 74410. , 165000. , 242000. , 0. , 0. , 0. , 79
4 84184.1 , 151280. , 276000. , 0. , 0. , 0. , 80
5 49266.7 , 164765. , 240600. , 0. , 0. , 0. , 81
6 59819.4 , 121243. , 257592. , 341350. , 555000. , 0. , 82
7 58790. , 134600. , 206180. , 365500. , 451700. , 712000. , 83
8 67885.3 , 153000. , 218000. , 0. , 0. , 0. , 84
9 75000. , 161000. , 242000. , 0. , 0. , 0. , 85
T 86692.5 , 161000. , 242000. , 0. , 0. , 0. , 86
1 32000. , 177000. , 266000. , 0. , 0. , 0. , 87
2 42577.35 , 81842.31 , 274000. , 0. , 0. , 0. , 88
3 41700. , 97300. , 161000. , 0. , 0. , 0. , 89
4 49000. , 93000. , 161000. , 231900. , 0. , 0. , 90
5 47500. , 95000. , 161000. , 0. , 0. , 0. , 91
6 48800. , 95000. , 161000. , 0. , 0. , 0. , 92
7 49900. , 95000. , 161000. , 0. , 0. , 0. , 93
8 48900. , 95000. , 161000. , 0. , 0. , 0. , 94
9 48300. , 95000. , 161000. , 0. , 0. , 0. / 95
DATA POTF/
1 48600. , 95000. , 161000. , 0. , 0. , 0. , 96
2 50200. , 95000. , 161000. , 0. , 0. , 0. , 97
3 50800. , 95000. , 161000. , 0. , 0. , 0. , 98
4 51800. , 95000. , 161000. , 0. , 0. , 0. / 99
RETURN
END
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