Searched refs:iforwhat (Results 1 – 6 of 6) sorted by relevance
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/NWints/texas/ |
H A D | texas_face.F | 2025 iforwhat=0 2029 iforwhat=1 2033 iforwhat=2 2037 iforwhat=3 2041 iforwhat=4 2044 if(iforwhat.eq.0) then 2057 iforinit=iforwhat 2099 if(iforwhat.eq.1) 2101 if(iforwhat.eq.2) 2103 if(iforwhat.eq.3) [all …]
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H A D | texas_hf.F | 187 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat 1003 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat 1006 if(iforwhat.eq.2) n_times= 6 ! giao Ist derivatives 1007 if(iforwhat.eq.3) n_times=12 ! gradient derivatives 1008 if(iforwhat.eq.4) n_times=78 ! hessian derivatives 1117 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat 1120 if(iforwhat.eq.2) n_times= 6 ! giao Ist derivatives 1121 if(iforwhat.eq.3) n_times=12 ! gradient derivatives 1122 if(iforwhat.eq.4) n_times=78 ! hessian derivatives 1481 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat [all …]
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H A D | spec_block.F | 145 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat local 325 call get_limit(mmax,icache,nfijkl,iforwhat,ibl,kbl, 346 * memor_const,memor2ij,memor2kl,memor4,iforwhat) 351 * memor_const,memor2ij,memor2kl,memor4,iforwhat)
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/NWints/texas/ |
H A D | texas_face.F | 2025 iforwhat=0 2029 iforwhat=1 2033 iforwhat=2 2037 iforwhat=3 2041 iforwhat=4 2044 if(iforwhat.eq.0) then 2057 iforinit=iforwhat 2099 if(iforwhat.eq.1) 2101 if(iforwhat.eq.2) 2103 if(iforwhat.eq.3) [all …]
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H A D | texas_hf.F | 187 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat local 1003 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat local 1006 if(iforwhat.eq.2) n_times= 6 ! giao Ist derivatives 1007 if(iforwhat.eq.3) n_times=12 ! gradient derivatives 1008 if(iforwhat.eq.4) n_times=78 ! hessian derivatives 1117 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat local 1120 if(iforwhat.eq.2) n_times= 6 ! giao Ist derivatives 1121 if(iforwhat.eq.3) n_times=12 ! gradient derivatives 1122 if(iforwhat.eq.4) n_times=78 ! hessian derivatives 1481 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat local [all …]
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H A D | spec_block.F | 145 common /mem_max_min/ ispblx,maxme1,max_111,iforwhat 325 call get_limit(mmax,icache,nfijkl,iforwhat,ibl,kbl, 346 * memor_const,memor2ij,memor2kl,memor4,iforwhat) 351 * memor_const,memor2ij,memor2kl,memor4,iforwhat)
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