Searched refs:c12p1 (Results 1 – 4 of 4) sorted by relevance
/dports/science/nwchem-data/nwchem-7.0.2-release/src/argos/ |
H A D | argos_cafe_fw.F | 49 real*8 danglep,c6p1,c12p1,c6p2,c12p2,qip1,qjp1,qip2,qjp2 465 c12p1=zero 479 c12p1=vdw(iwatm(iwa),iwatm(jwa),4,2) 522 if(ip2(2)) ep2l=ep2l-eterml+(c12p1*r6i-c6p1)*r6i 580 c12p1=vdw(iwatm(iwa),iwatm(jwa),3,2) 631 if(ip2(2)) ep2l=ep2l-eterml+(c12p1*r6i-c6p1)*r6i
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/argos/ |
H A D | argos_cafe_fw.F | 49 real*8 danglep,c6p1,c12p1,c6p2,c12p2,qip1,qjp1,qip2,qjp2 local 465 c12p1=zero 479 c12p1=vdw(iwatm(iwa),iwatm(jwa),4,2) 522 if(ip2(2)) ep2l=ep2l-eterml+(c12p1*r6i-c6p1)*r6i 580 c12p1=vdw(iwatm(iwa),iwatm(jwa),3,2) 631 if(ip2(2)) ep2l=ep2l-eterml+(c12p1*r6i-c6p1)*r6i
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/cafe/ |
H A D | cf_f.fh | 4945 real*8 danglep,c6p1,c12p1,c6p2,c12p2,qip1,qjp1,qip2,qjp2 5361 c12p1=zero 5375 c12p1=vdw(iwatm(iwa),iwatm(jwa),4,2) 5418 if(ip2(2)) ep2l=ep2l-eterml+(c12p1*r6i-c6p1)*r6i 5476 c12p1=vdw(iwatm(iwa),iwatm(jwa),3,2) 5527 if(ip2(2)) ep2l=ep2l-eterml+(c12p1*r6i-c6p1)*r6i
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/cafe/ |
H A D | cf_f.fh | 4945 real*8 danglep,c6p1,c12p1,c6p2,c12p2,qip1,qjp1,qip2,qjp2 5361 c12p1=zero 5375 c12p1=vdw(iwatm(iwa),iwatm(jwa),4,2) 5418 if(ip2(2)) ep2l=ep2l-eterml+(c12p1*r6i-c6p1)*r6i 5476 c12p1=vdw(iwatm(iwa),iwatm(jwa),3,2) 5527 if(ip2(2)) ep2l=ep2l-eterml+(c12p1*r6i-c6p1)*r6i
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