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Searched refs:spcart_tran1e (Results 1 – 25 of 32) sorted by relevance

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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/NWints/api/
H A Dint_1estv.F325 if (doS) call spcart_tran1e(S,scr,
329 if (doT) call spcart_tran1e(T,scr,
333 if (doV) call spcart_tran1e(V,scr,
343 if (doS) call spcart_tran1e(S,scr,
347 if (doT) call spcart_tran1e(T,scr,
351 if (doV) call spcart_tran1e(V,scr,
361 if (doS) call spcart_tran1e(S,scr,
365 if (doT) call spcart_tran1e(T,scr,
369 if (doV) call spcart_tran1e(V,scr,
1033 if (doS) call spcart_tran1e(S,scr,
[all …]
H A Dintdd_1eh1.F251 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
261 call spcart_tran1e(Ta(1,zyx1,zyx2,zatom),scr,
277 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
287 call spcart_tran1e(Ta(1,zyx1,zyx2,zatom),scr,
303 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
313 call spcart_tran1e(Ta(1,zyx1,zyx2,zatom),scr,
H A Dint_1epvpe.F183 call spcart_tran1e(pvpe,scr,
193 call spcart_tran1e(pvpe,scr,
203 call spcart_tran1e(pvpe,scr,
H A Dint_1epxvpe.F153 call spcart_tran1e(pvpe(1,icomp),scr,
165 call spcart_tran1e(pvpe(1,icomp),scr,
177 call spcart_tran1e(pvpe(1,icomp),scr,
H A Dint_vstat1e.F168 call spcart_tran1e(vint,scr,
178 call spcart_tran1e(vint,scr,
188 call spcart_tran1e(vint,scr,
H A Dintdd_1eov.F259 call spcart_tran1e(Ova(1,zyx1,zyx2,zatom),scr,
275 call spcart_tran1e(Ova(1,zyx1,zyx2,zatom),scr,
291 call spcart_tran1e(Ova(1,zyx1,zyx2,zatom),scr,
H A Dintdd_1eecp1.F257 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
273 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
289 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
H A Dintd_1eov.F349 call spcart_tran1e(Ova(1,zyx,zatom),scr,
363 call spcart_tran1e(Ova(1,Zyx,Zatom),scr,
377 call spcart_tran1e(Ova(1,Zyx,Zatom),scr,
H A Dintd_1eke.F343 call spcart_tran1e(Ta(1,zyx,zatom),scr,
357 call spcart_tran1e(Ta(1,Zyx,Zatom),scr,
371 call spcart_tran1e(Ta(1,Zyx,Zatom),scr,
H A Dintd_1epot_cosmo.F495 call spcart_tran1e(H1a(1,zyx,zatom),scr,
509 call spcart_tran1e(H1a(1,zyx,zatom),scr,
523 call spcart_tran1e(H1a(1,zyx,zatom),scr,
H A Dintd_1eh1.F420 call spcart_tran1e(H1a(1,zyx,zatom),scr,
434 call spcart_tran1e(H1a(1,zyx,zatom),scr,
448 call spcart_tran1e(H1a(1,zyx,zatom),scr,
H A Dintd_1epot.F464 call spcart_tran1e(H1a(1,zyx,zatom),scr,
478 call spcart_tran1e(H1a(1,zyx,zatom),scr,
492 call spcart_tran1e(H1a(1,zyx,zatom),scr,
H A Dint_1cg.F137 call spcart_tran1e(G1e,scr,
/dports/science/nwchem-data/nwchem-7.0.2-release/src/NWints/api/
H A Dint_1estv.F325 if (doS) call spcart_tran1e(S,scr,
329 if (doT) call spcart_tran1e(T,scr,
333 if (doV) call spcart_tran1e(V,scr,
343 if (doS) call spcart_tran1e(S,scr,
347 if (doT) call spcart_tran1e(T,scr,
351 if (doV) call spcart_tran1e(V,scr,
361 if (doS) call spcart_tran1e(S,scr,
365 if (doT) call spcart_tran1e(T,scr,
369 if (doV) call spcart_tran1e(V,scr,
1033 if (doS) call spcart_tran1e(S,scr,
[all …]
H A Dintdd_1eh1.F251 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
261 call spcart_tran1e(Ta(1,zyx1,zyx2,zatom),scr,
277 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
287 call spcart_tran1e(Ta(1,zyx1,zyx2,zatom),scr,
303 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
313 call spcart_tran1e(Ta(1,zyx1,zyx2,zatom),scr,
H A Dint_1epvpe.F183 call spcart_tran1e(pvpe,scr,
193 call spcart_tran1e(pvpe,scr,
203 call spcart_tran1e(pvpe,scr,
H A Dint_1epxvpe.F153 call spcart_tran1e(pvpe(1,icomp),scr,
165 call spcart_tran1e(pvpe(1,icomp),scr,
177 call spcart_tran1e(pvpe(1,icomp),scr,
H A Dint_vstat1e.F168 call spcart_tran1e(vint,scr,
178 call spcart_tran1e(vint,scr,
188 call spcart_tran1e(vint,scr,
H A Dintdd_1eov.F259 call spcart_tran1e(Ova(1,zyx1,zyx2,zatom),scr,
275 call spcart_tran1e(Ova(1,zyx1,zyx2,zatom),scr,
291 call spcart_tran1e(Ova(1,zyx1,zyx2,zatom),scr,
H A Dintdd_1eecp1.F257 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
273 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
289 call spcart_tran1e(H1a(1,zyx1,zyx2,zatom),scr,
H A Dintd_1epot_cosmo.F495 call spcart_tran1e(H1a(1,zyx,zatom),scr,
509 call spcart_tran1e(H1a(1,zyx,zatom),scr,
523 call spcart_tran1e(H1a(1,zyx,zatom),scr,
H A Dintd_1eke.F343 call spcart_tran1e(Ta(1,zyx,zatom),scr,
357 call spcart_tran1e(Ta(1,Zyx,Zatom),scr,
371 call spcart_tran1e(Ta(1,Zyx,Zatom),scr,
H A Dintd_1eov.F349 call spcart_tran1e(Ova(1,zyx,zatom),scr,
363 call spcart_tran1e(Ova(1,Zyx,Zatom),scr,
377 call spcart_tran1e(Ova(1,Zyx,Zatom),scr,
H A Dintd_1eh1.F420 call spcart_tran1e(H1a(1,zyx,zatom),scr,
434 call spcart_tran1e(H1a(1,zyx,zatom),scr,
448 call spcart_tran1e(H1a(1,zyx,zatom),scr,
H A Dintd_1epot.F464 call spcart_tran1e(H1a(1,zyx,zatom),scr,
478 call spcart_tran1e(H1a(1,zyx,zatom),scr,
492 call spcart_tran1e(H1a(1,zyx,zatom),scr,

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