| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | xas_restart.F | 112 INTEGER :: group, handle, i, ia, ie, ispin, my_spin, nao, nao_read, nelectron, nexc_atoms, & local
378 INTEGER :: handle, ispin, my_spin, nelectron local
454 INTEGER :: i, ic_max, ir_max, m, my_spin, n, nao, & local
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| H A D | xas_methods.F | 163 INTEGER :: handle, homo, i, iat, iatom, ispin, istate, my_homo(2), my_nelectron(2), my_spin, & local
594 INTEGER :: homo, i, iat, iatom, ik, ikind, ispin, j, l, lfomo, my_spin, n_mo(2), n_rep, nao, & local
1041 INTEGER :: homo, i, lfomo, my_spin, nabs, nmo, & local
1238 INTEGER :: homo, istate0, my_spin, nspins, nstates local
1335 all_vectors, all_evals, sp_em, sp_ab, estate, nstate, my_spin) argument
1343 INTEGER, INTENT(IN) :: estate, nstate, my_spin local
1503 my_spin, nao, natom, nexc_atoms, & local
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| H A D | xas_tp_scf.F | 147 iter_count, my_spin, nspin, occ_spin, & local
405 INTEGER :: handle, i, ikind, isgf, ispin, istate, j, my_kind, my_spin, my_state, nao, natom, & local
647 INTEGER :: handle, ispin, istate, my_spin, nmo, & local
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| H A D | qs_pdos.F | 167 maxlgto, my_spin, n_dependent, n_r_ldos, n_rep, nao, natom, ncol_global, nkind, nldos, & local
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| H A D | qs_loc_utils.F | 1736 SUBROUTINE set_loc_wfn_lists(localized_wfn_control, nmoloc, nmo, nspins, my_spin) argument
1741 INTEGER, INTENT(IN), OPTIONAL :: my_spin local
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | xas_restart.F | 112 INTEGER :: group, handle, i, ia, ie, ispin, my_spin, nao, nao_read, nelectron, nexc_atoms, & local
378 INTEGER :: handle, ispin, my_spin, nelectron local
454 INTEGER :: i, ic_max, ir_max, m, my_spin, n, nao, & local
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| H A D | xas_methods.F | 163 INTEGER :: handle, homo, i, iat, iatom, ispin, istate, my_homo(2), my_nelectron(2), my_spin, & local
594 INTEGER :: homo, i, iat, iatom, ik, ikind, ispin, j, l, lfomo, my_spin, n_mo(2), n_rep, nao, & local
1041 INTEGER :: homo, i, lfomo, my_spin, nabs, nmo, & local
1238 INTEGER :: homo, istate0, my_spin, nspins, nstates local
1335 all_vectors, all_evals, sp_em, sp_ab, estate, nstate, my_spin) argument
1343 INTEGER, INTENT(IN) :: estate, nstate, my_spin local
1503 my_spin, nao, natom, nexc_atoms, & local
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| H A D | xas_tp_scf.F | 147 iter_count, my_spin, nspin, occ_spin, & local
405 INTEGER :: handle, i, ikind, isgf, ispin, istate, j, my_kind, my_spin, my_state, nao, natom, & local
647 INTEGER :: handle, ispin, istate, my_spin, nmo, & local
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| H A D | qs_pdos.F | 167 maxlgto, my_spin, n_dependent, n_r_ldos, n_rep, nao, natom, ncol_global, nkind, nldos, & local
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| H A D | qs_loc_utils.F | 1708 SUBROUTINE set_loc_wfn_lists(localized_wfn_control, nmoloc, nmo, nspins, my_spin) argument
1713 INTEGER, INTENT(IN), OPTIONAL :: my_spin local
|