/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/property/ |
H A D | hnd_eldmap.F | 23 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_eden, k_eden 58 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 149 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_eldmap_grid.F | 26 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt 83 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 195 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_mtpole.F | 39 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt local 85 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 374 if (.not.ma_pop_stack(l_xyzpt)) call errquit 570 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt local 616 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 727 if (.not.ma_pop_stack(l_xyzpt)) call errquit 781 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt local 818 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 929 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_spind.F | 25 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_efgs, k_efgs 83 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 235 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_elfmap.F | 25 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_efld, k_efld local 106 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 306 if (.not.ma_chop_stack(l_xyzpt)) call errquit
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H A D | hnd_efgmap.F | 27 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_efgs, k_efgs 72 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 279 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_elpmap.F | 27 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_epot, k_epot 114 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 389 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_efgmap_z4.F | 34 integer l_xyzpt , k_xyzpt, 110 & mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 555 if (.not.ma_free_heap(l_xyzpt)) call
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/property/ |
H A D | hnd_eldmap.F | 23 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_eden, k_eden 58 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 149 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_eldmap_grid.F | 26 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt 83 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 195 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_mtpole.F | 39 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt 85 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 374 if (.not.ma_pop_stack(l_xyzpt)) call errquit 570 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt 616 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 727 if (.not.ma_pop_stack(l_xyzpt)) call errquit 781 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt 818 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 929 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_elfmap.F | 25 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_efld, k_efld 106 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 306 if (.not.ma_chop_stack(l_xyzpt)) call errquit
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H A D | hnd_spind.F | 25 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_efgs, k_efgs 83 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 235 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_efgmap.F | 27 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_efgs, k_efgs 72 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 279 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_elpmap.F | 27 integer l_xyzpt, k_xyzpt, l_zanpt, k_zanpt, l_epot, k_epot 114 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 389 if (.not.ma_pop_stack(l_xyzpt)) call errquit
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H A D | hnd_efgmap_z4.F | 34 integer l_xyzpt , k_xyzpt, 110 & mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 555 if (.not.ma_free_heap(l_xyzpt)) call
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwdft/zora/ |
H A D | dft_zora_rhos_so.F | 41 integer l_xyzpt,k_xyzpt, 74 if (.not. ma_alloc_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 205 if (.not.ma_free_heap(l_xyzpt)) call errquit 416 integer l_xyzpt , k_xyzpt, 491 & mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 873 if (.not.ma_free_heap(l_xyzpt)) call
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H A D | dft_zora_Hyperfine.F | 200 integer l_xyzpt,k_xyzpt, 267 & 'xyz pnt',l_xyzpt,k_xyzpt)) 492 if (.not.ma_free_heap(l_xyzpt)) call errquit 540 integer l_xyzpt,k_xyzpt, 566 if (.not. ma_alloc_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 749 if (.not.ma_free_heap(l_xyzpt)) call errquit
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H A D | dft_zora_rhos.F | 32 integer l_xyzpt,k_xyzpt, 73 if (.not. ma_alloc_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 267 if (.not.ma_free_heap(l_xyzpt)) call errquit
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H A D | dft_zora_NMR.F | 205 integer l_xyzpt,k_xyzpt, 243 if (.not. ma_alloc_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 484 if (.not.ma_free_heap(l_xyzpt)) call errquit
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/nwdft/zora/ |
H A D | dft_zora_rhos_so.F | 41 integer l_xyzpt,k_xyzpt, 74 if (.not. ma_alloc_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 205 if (.not.ma_free_heap(l_xyzpt)) call errquit 416 integer l_xyzpt , k_xyzpt, 491 & mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 873 if (.not.ma_free_heap(l_xyzpt)) call
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H A D | dft_zora_Hyperfine.F | 200 integer l_xyzpt,k_xyzpt, 267 & 'xyz pnt',l_xyzpt,k_xyzpt)) 492 if (.not.ma_free_heap(l_xyzpt)) call errquit 540 integer l_xyzpt,k_xyzpt, 566 if (.not. ma_alloc_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 749 if (.not.ma_free_heap(l_xyzpt)) call errquit
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H A D | dft_zora_rhos.F | 32 integer l_xyzpt,k_xyzpt, 73 if (.not. ma_alloc_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 267 if (.not.ma_free_heap(l_xyzpt)) call errquit
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H A D | dft_zora_NMR.F | 205 integer l_xyzpt,k_xyzpt, 243 if (.not. ma_alloc_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt)) 484 if (.not.ma_free_heap(l_xyzpt)) call errquit
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/solvation/ |
H A D | hnd_coschg.F | 525 integer l_epot, l_xyzpt, l_zanpt ! memory handles 698 if (.not. ma_push_get(mt_dbl,3*nat,'xyz pnt',l_xyzpt,k_xyzpt))
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