/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | hfx_communication.F | 93 jset, mepos, ncpu, nseta, nsetb, pa, pa1, pb, pb1, req(2), source, source_cpu local 220 jkind, jset, mepos, ncpu, nseta, nsetb, pa, pa1, pb, pb1, req(2), source local 455 natom, ncpu, nseta, nsetb, number_of_p_blocks, offset, tmp(2) local
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H A D | generic_os_integrals.F | 158 nseta, nsetb, sgfa, sgfb local 283 ncoa, ncob, nseta, nsetb, sgfa, sgfb local 411 ncoa, ncob, nseta, nsetb, sgfa, sgfb local 519 m3, ncoa, ncob, ncoc, nseta, nsetb, & local 681 m3, ncoa, ncob, ncoc, nseta, nsetb, & local 837 m4, maxco, maxcoa, maxcob, maxl, maxla, maxlb, ncoa1, ncoa2, ncob1, ncob2, nseta, nsetb, & local
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H A D | hfx_pair_list_methods.F | 479 n_element, nset_ij, nseta, nsetb local 568 jblock, jkind, nseta, nsetb local 657 n_element, nset_ij, nseta, nsetb local
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H A D | qs_oce_methods.F | 85 maxder, maxlb, maxlprj, maxnprja, maxsoa, msab, n, ncob, np_car, np_sph, nsatbas, nseta, & local 285 maxsoa, n, nsatbas, nseta, nsgfa local 372 ncoa_sum, nkind, nlist, nneighbor, nsatbas, nseta, nsetb, nsgf_cnt, nsgfa, nsobtot, slot local
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H A D | qs_fermi_contact.F | 82 last_jatom, ldai, ldfc, maxco, maxlgto, maxsgf, natom, ncoa, ncob, nkind, nseta, nsetb, & local
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H A D | qs_spin_orbit.F | 82 nseta, nsetb, sgfa, sgfb local
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H A D | qs_elec_field.F | 83 nseta, nsetb, sgfa, sgfb local
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H A D | qs_operators_ao.F | 78 ldai, maxco, maxlgto, maxsgf, natom, ncoa, ncob, neighbor_list_id, nkind, nseta, nsetb, & local 433 ldai, maxco, maxlgto, maxsgf, natom, ncoa, ncob, neighbor_list_id, nkind, nseta, nsetb, & local 809 ldab, ldsa, ldsb, ldwork, maxl, ncoa, ncob, nkind, nseta, nsetb, sgfa, sgfb local 1077 last_jatom, ldab, ldsa, ldsb, ldwork, M_dim, maxl, ncoa, ncob, nkind, nseta, nsetb, sgfa, & local 1340 na, nb, ncoa, ncob, nda, ndb, nkind, nseta, nsetb, sgfa, sgfb local
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H A D | qs_overlap.F | 185 maxder, maxs, n1, n2, ncoa, ncob, nder, nimg, nkind, nseta, nsetb, sgfa, sgfb, slot local 571 n2, natom, ncoa, ncob, nkind, nseta, & local 798 natom, ncoa, ncob, nder, nkind, nseta, & local
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H A D | core_ppl.F | 108 n_local, natom, ncoa, ncob, nexp_lpot, nexp_ppl, nkind, nloc, nseta, nsetb, nthread, & local 580 natom, ncoa, nexp_lpot, nexp_ppl, nfun, nkind, nloc, nseta, sgfa, sgfb, slot local
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | hfx_communication.F | 93 jset, mepos, ncpu, nseta, nsetb, pa, pa1, pb, pb1, req(2), source, source_cpu local 220 jkind, jset, mepos, ncpu, nseta, nsetb, pa, pa1, pb, pb1, req(2), source local 455 natom, ncpu, nseta, nsetb, number_of_p_blocks, offset, tmp(2) local
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H A D | generic_os_integrals.F | 158 nseta, nsetb, sgfa, sgfb local 283 ncoa, ncob, nseta, nsetb, sgfa, sgfb local 411 ncoa, ncob, nseta, nsetb, sgfa, sgfb local 519 m3, ncoa, ncob, ncoc, nseta, nsetb, & local 681 m3, ncoa, ncob, ncoc, nseta, nsetb, & local 837 m4, maxco, maxcoa, maxcob, maxl, maxla, maxlb, ncoa1, ncoa2, ncob1, ncob2, nseta, nsetb, & local
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H A D | hfx_pair_list_methods.F | 479 n_element, nset_ij, nseta, nsetb local 568 jblock, jkind, nseta, nsetb local 657 n_element, nset_ij, nseta, nsetb local
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H A D | qs_oce_methods.F | 90 maxder, maxlb, maxlprj, maxnprja, maxsoa, msab, n, ncob, np_car, np_sph, nsatbas, nseta, & local 280 maxsoa, n, nsatbas, nseta, nsgfa local 367 ncoa_sum, nkind, nlist, nneighbor, nsatbas, nseta, nsetb, nsgf_cnt, nsgfa, nsobtot local
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H A D | qs_elec_field.F | 83 nseta, nsetb, sgfa, sgfb local
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H A D | qs_fermi_contact.F | 82 last_jatom, ldai, ldfc, maxco, maxlgto, maxsgf, natom, ncoa, ncob, nkind, nseta, nsetb, & local
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H A D | qs_spin_orbit.F | 82 nseta, nsetb, sgfa, sgfb local
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H A D | qs_overlap.F | 138 jset, ldsab, maxder, maxs, mepos, n1, n2, natom, ncoa, ncob, nder, nimg, nkind, nseta, & local 484 ldsab, m1, m2, mepos, n1, n2, natom, ncoa, ncob, nkind, nseta, nsetb, nthread, sgfa, sgfb local 692 ldsab, n1, n2, ncoa, ncob, nder, nkind, nseta, nsetb, sgfa, sgfb local
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H A D | qs_operators_ao.F | 78 ldai, maxco, maxlgto, maxsgf, natom, ncoa, ncob, neighbor_list_id, nkind, nseta, nsetb, & local 433 ldai, maxco, maxlgto, maxsgf, natom, ncoa, ncob, neighbor_list_id, nkind, nseta, nsetb, & local 809 ldab, ldsa, ldsb, ldwork, maxl, ncoa, ncob, nkind, nseta, nsetb, sgfa, sgfb local 1077 last_jatom, ldab, ldsa, ldsb, ldwork, M_dim, maxl, ncoa, ncob, nkind, nseta, nsetb, sgfa, & local 1340 na, nb, ncoa, ncob, nda, ndb, nkind, nseta, nsetb, sgfa, sgfb local
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H A D | qs_kinetic.F | 112 ldsab, mepos, natom, ncoa, ncob, nimg, nkind, nseta, nsetb, nthread, sgfa, sgfb local
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H A D | core_ppl.F | 106 nseta, nsetb, nthread, sgfa, sgfb local 542 maxsgf, mepos, n_local, natom, ncoa, nexp_lpot, nexp_ppl, nfun, nkind, nloc, nseta, & local
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H A D | commutator_rpnl.F | 78 nlist, nneighbor, nnode, np, nppnl, nprjc, nseta, nsgfa, nthread, prjc, sgfa local
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H A D | hfx_types.F | 478 n_threads, natom_a, natom_b, nkind, nseta, nsetb, pbc_shells, storage_id local 865 max_nsgfl, max_pgf, max_pgf_kind, max_set, nkind, nl_count, nset, nseta, offset_a, & local 1261 m(3), max_shell, nseta, nsetb, total_number_of_cells, ub, ub_max local
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/shg_int/ |
H A D | generic_shg_integrals.F | 442 npgfb_set, nseta, nsetb, nsgfa_set, nsgfb_set, nshella_set, nshellb_set local 561 npgfb_set, nseta, nsetb, nshella_set, & local 692 npgfb_set, nseta, nsetb, nshella_set, & local 817 nb, ncb, ndev, nds, nds_max, nl, nl_set, npgfa_set, npgfb_set, npgfcb_set, nseta, nsetb, & local 979 kset, ksgfa, kshella, kstart, lai, laj, lak, nseta, nsetca, nsgfa, nsgfca, sgfa_end, & local 1129 nb, nca, ndev, nds, nds_max, nl, nl_set, npgfa_set, npgfb_set, npgfca_set, nseta, nsetb, & local
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/dports/science/cp2k-data/cp2k-7.1.0/src/shg_int/ |
H A D | generic_shg_integrals.F | 442 npgfb_set, nseta, nsetb, nsgfa_set, nsgfb_set, nshella_set, nshellb_set local 561 npgfb_set, nseta, nsetb, nshella_set, & local 692 npgfb_set, nseta, nsetb, nshella_set, & local 817 nb, ncb, ndev, nds, nds_max, nl, nl_set, npgfa_set, npgfb_set, npgfcb_set, nseta, nsetb, & local 979 kset, ksgfa, kshella, kstart, lai, laj, lak, nseta, nsetca, nsgfa, nsgfca, sgfa_end, & local 1129 nb, nca, ndev, nds, nds_max, nl, nl_set, npgfa_set, npgfb_set, npgfca_set, nseta, nsetb, & local
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