Searched refs:epsds (Results 1 – 6 of 6) sorted by relevance
/dports/science/nwchem-data/nwchem-7.0.2-release/src/argos/ |
H A D | argos_stdesc.F | 21 real*8 edif,epsd,epsdw,epsdsw,epsds,ecrit 63 epsds=epots 241 epsds=epots 268 write(lfnout,600) isdit,cqrs,edif,epsd,epsdw,epsdsw,epsds,dxmax
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/argos/ |
H A D | argos_stdesc.F | 21 real*8 edif,epsd,epsdw,epsdsw,epsds,ecrit 63 epsds=epots 241 epsds=epots 268 write(lfnout,600) isdit,cqrs,edif,epsd,epsdw,epsdsw,epsds,dxmax
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/dports/science/tinker/tinker/source/ |
H A D | induce.f | 4465 real*8 epsds,epsps local 4791 epsds = 0.0d0 4802 epsds = epsds + rsds(j,i)*rsds(j,i) 4811 eps = max(epsd,epsp,epsds,epsps) 5788 real*8 epsds,epsps local 6114 epsds = 0.0d0 6125 epsds = epsds + rsds(j,i)*rsds(j,i) 6134 eps = max(epsd,epsp,epsds,epsps)
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwmd/ |
H A D | md_main.F | 389 real*8 edif,epsd,epsdw,epsdsw,epsds,ecrit 442 epsds=epots 622 epsds=epots 654 write(lfnout,600) isdit,cqrs,edif,epsd,epsdw,epsdsw,epsds,dxmax
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwmd/ |
H A D | md_main.F | 389 real*8 edif,epsd,epsdw,epsdsw,epsds,ecrit 442 epsds=epots 622 epsds=epots 654 write(lfnout,600) isdit,cqrs,edif,epsd,epsdw,epsdsw,epsds,dxmax
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/dports/science/tinker/tinker/other/ |
H A D | induce.no-tarray | 3277 real*8 epsds,epsps 3528 epsds = 0.0d0 3538 epsds = epsds + rsds(j,i)*rsds(j,i) 3546 eps = max(epsd,epsp,epsds,epsps) 4379 real*8 epsds,epsps 4630 epsds = 0.0d0 4640 epsds = epsds + rsds(j,i)*rsds(j,i) 4648 eps = max(epsd,epsp,epsds,epsps)
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