Home
last modified time | relevance | path

Searched refs:derco1 (Results 1 – 6 of 6) sorted by relevance

/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/argos/
H A Dargos_cafe_fpsw.F48 real*8 c64,c124,dercon,qj,qj4,derco1,derco2 local
457 derco1=zero
464 derco1=derco1+drvco1
468 deriv(5,ipsw)=deriv(5,ipsw)+derco1
475 derco1=derco1+drvco1
488 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
496 derco1=derco1+drvco1
500 deriv(5,ipsw)=deriv(5,ipsw)+derco1
507 derco1=derco1+drvco1
520 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
H A Dargos_cafe_fsw.F46 real*8 c64,c124,dercon,qj,qj4,derco1,derco2
669 derco1=zero
676 derco1=derco1+drvco1
682 deriv(5,ipsw)=deriv(5,ipsw)+derco1
689 derco1=derco1+drvco1
704 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
712 derco1=derco1+drvco1
718 deriv(5,ipsw)=deriv(5,ipsw)+derco1
725 derco1=derco1+drvco1
740 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
/dports/science/nwchem-data/nwchem-7.0.2-release/src/argos/
H A Dargos_cafe_fpsw.F48 real*8 c64,c124,dercon,qj,qj4,derco1,derco2
457 derco1=zero
464 derco1=derco1+drvco1
468 deriv(5,ipsw)=deriv(5,ipsw)+derco1
475 derco1=derco1+drvco1
488 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
496 derco1=derco1+drvco1
500 deriv(5,ipsw)=deriv(5,ipsw)+derco1
507 derco1=derco1+drvco1
520 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
H A Dargos_cafe_fsw.F46 real*8 c64,c124,dercon,qj,qj4,derco1,derco2
669 derco1=zero
676 derco1=derco1+drvco1
682 deriv(5,ipsw)=deriv(5,ipsw)+derco1
689 derco1=derco1+drvco1
704 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
712 derco1=derco1+drvco1
718 deriv(5,ipsw)=deriv(5,ipsw)+derco1
725 derco1=derco1+drvco1
740 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
/dports/science/nwchem-data/nwchem-7.0.2-release/src/cafe/
H A Dcf_f.fh807 real*8 c64,c124,dercon,qj,qj4,derco1,derco2
1573 derco1=zero
1580 derco1=derco1+drvco1
1588 deriv(5,ipsw)=deriv(5,ipsw)+derco1
1595 derco1=derco1+drvco1
1612 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
1620 derco1=derco1+drvco1
1628 deriv(5,ipsw)=deriv(5,ipsw)+derco1
1635 derco1=derco1+drvco1
1652 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/cafe/
H A Dcf_f.fh807 real*8 c64,c124,dercon,qj,qj4,derco1,derco2
1573 derco1=zero
1580 derco1=derco1+drvco1
1588 deriv(5,ipsw)=deriv(5,ipsw)+derco1
1595 derco1=derco1+drvco1
1612 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3
1620 derco1=derco1+drvco1
1628 deriv(5,ipsw)=deriv(5,ipsw)+derco1
1635 derco1=derco1+drvco1
1652 deriv(5,ipsw)=deriv(5,ipsw)+derco1+half*derco3