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Searched refs:NCDET (Results 1 – 6 of 6) sorted by relevance

/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/sirius/
H A Dcisig.F180 NCDET = NDTASM(LSYM)
187 NCDET = NCONF
197 KLFREE = KLC2 + MAX(N2ASHX, NCDET )
200 KLDET2 = KLDET1 + NCDET
201 KLFREE = KLDET2 + NCDET
283 call wrtmatmn(CVEC(1,IVEC),1,NCDET,1,NCDET,lupri)
338 call wrtmatmn(CVEC(1,IVEC),1,NCDET,1,NCDET,lupri)
812 NCDET = NDTASM(ICSYM)
1263 NCDET = NDTASM(ICSYM)
1265 NDET = MAX(NCDET,NHCDET)
[all …]
H A Dgetcix.F106 CALL DETINF(NACTEL,NASHT,MULD2H,ISPIN,NCDET,NHCDET,ICSYM,IHCSYM,
310 * NCDET,NCCSF,LCINSV,LACISV,LBCISV,WORK,LFREEL,
353 NCDET = NDTASM(ICSYM)
358 IF (NCDET .LE. 0) THEN
378 * ' Number of determinants: ',NCDET
H A Ddets0.F729 * NCDET,NHCDET,ICSYM,IHCSYM,
1092 NCDET = NDTASM(ICSYM)
1097 * ' NUMBER OF DETERMINANTS GENERATED',NCDET
1139 WRITE(LUSTR) NCDET,NHCDET
H A Ddetfi.F703 & NCDET,NCCSF,LCINDX,LLOCA,LLOCB,WORK,LFREE,
877 NCDET = NDTASM(ICSYM)
892 NCCSF = NCDET
H A Dcsfstuff.F3269 & NORB,C,HC,NCDET,NHCDET,NSTASA,NSTASB,
3306 DIMENSION C(NCDET),HC(NHCDET)
/dports/science/xcrysden/xcrysden-1.6.2/F/
H A Dgengeom.f787 NCELL=NCDET(IGROUP)
896 INTEGER FUNCTION NCDET(IGROUP) function
898 IF(IGROUP.EQ.1 .OR. IGROUP.EQ.9) NCDET=1
899 IF((IGROUP.GT.1.AND.IGROUP.LT.5).OR.(IGROUP.EQ.6)) NCDET=2
900 IF(IGROUP.EQ.5) NCDET=4
901 IF(IGROUP.EQ.7.OR.IGROUP.EQ.8) NCDET=3