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Searched refs:GETH1E (Results 1 – 7 of 7) sorted by relevance

/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/lucita/
H A Ddalton_interface.F812 H(IJ) = GETH1E(I,ITP,ISM,J,JTP,JSM)
833 FUNCTION GETH1E(IORB,ITP,ISM,JORB,JTP,JSM) function
855 GETH1E =
859 GETH1E =
865 GETH1E =
893 GETH1I = GETH1E(IREL,ITP,ISM,JREL,JTP,JSM)
/dports/science/nwchem-data/nwchem-7.0.2-release/src/lucia/
H A Dlucia1.F3117 GETH1I = GETH1E(IREL,ITP,ISM,JREL,JTP,JSM)
3150 GETH1I_2 = GETH1E(IREL,ITP,ISM,JREL,JTP,JSM)
H A Dlucia7.F959 GETH1_B = GETH1E(IREL,ITP,ISM,JREL,JTP,JSM)
2765 & -1D0*(2D0*GETH1E(IPP,IPPTP,IPPSM,IPP,IPPTP,IPPSM))
2799 & *GETH1E(IQQ,IQQTP,IQQSM,IQQ,IQQTP,IQQSM)
H A Dlucia.F6317 H(IJ) = GETH1E(I,ITP,ISM,J,JTP,JSM)
6406 GETH1E = 0.0D0
6414 GETH1E =
6418 GETH1E =
6428 GETH1E =
6433 GETH1E =
6446 GETH1E =
6451 GETH1E =
6464 GETH1E =
6469 GETH1E =
[all …]
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/lucia/
H A Dlucia1.F3117 GETH1I = GETH1E(IREL,ITP,ISM,JREL,JTP,JSM)
3150 GETH1I_2 = GETH1E(IREL,ITP,ISM,JREL,JTP,JSM)
H A Dlucia7.F959 GETH1_B = GETH1E(IREL,ITP,ISM,JREL,JTP,JSM)
2765 & -1D0*(2D0*GETH1E(IPP,IPPTP,IPPSM,IPP,IPPTP,IPPSM))
2799 & *GETH1E(IQQ,IQQTP,IQQSM,IQQ,IQQTP,IQQSM)
H A Dlucia.F6317 H(IJ) = GETH1E(I,ITP,ISM,J,JTP,JSM)
6406 GETH1E = 0.0D0
6414 GETH1E =
6418 GETH1E =
6428 GETH1E =
6433 GETH1E =
6446 GETH1E =
6451 GETH1E =
6464 GETH1E =
6469 GETH1E =
[all …]