| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | qs_linres_current_utils.F | 146 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
595 INTEGER, ALLOCATABLE, DIMENSION(:) :: buff, first_sgf, last_sgf local
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| H A D | particle_methods.F | 93 SUBROUTINE get_particle_set(particle_set, qs_kind_set, first_sgf, last_sgf, nsgf, & argument
98 INTEGER, DIMENSION(:), INTENT(INOUT), OPTIONAL :: first_sgf, last_sgf, nsgf, nmao local
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| H A D | dft_plus_u.F | 219 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, l, last_sgf local
869 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, l, last_sgf local
1523 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, l, last_sgf local
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| H A D | atom_kind_orbitals.F | 118 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, last_sgf, ls local
848 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, last_sgf, ls local
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| H A D | qs_initial_guess.F | 139 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, kind_of, last_sgf local
1224 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf local
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| H A D | qs_dftb_matrices.F | 896 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
986 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
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| H A D | xas_tp_scf.F | 407 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf local
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| H A D | qs_scf_post_se.F | 405 INTEGER, DIMENSION(:, :), POINTER :: first_sgf local
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| H A D | xas_methods.F | 597 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, kind_type_tmp, kind_z_tmp, & local
1505 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf local
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| H A D | qs_linres_current.F | 185 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
2097 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
2524 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
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| H A D | paw_proj_set_types.F | 253 INTEGER, DIMENSION(:, :), POINTER :: first_cgf, first_sgf, l, last_cgf, & local
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | qs_linres_current_utils.F | 146 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
595 INTEGER, ALLOCATABLE, DIMENSION(:) :: buff, first_sgf, last_sgf local
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| H A D | particle_methods.F | 93 SUBROUTINE get_particle_set(particle_set, qs_kind_set, first_sgf, last_sgf, nsgf, & argument
98 INTEGER, DIMENSION(:), INTENT(INOUT), OPTIONAL :: first_sgf, last_sgf, nsgf, nmao local
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| H A D | dft_plus_u.F | 219 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, l, last_sgf local
869 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, l, last_sgf local
1523 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, l, last_sgf local
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| H A D | atom_kind_orbitals.F | 118 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, last_sgf, ls local
848 INTEGER, DIMENSION(:, :), POINTER :: first_sgf, last_sgf, ls local
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| H A D | qs_initial_guess.F | 144 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, kind_of, last_sgf local
1317 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf local
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| H A D | qs_dftb_matrices.F | 896 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
986 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
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| H A D | xas_tp_scf.F | 407 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf local
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| H A D | qs_tddfpt2_stda_utils.F | 430 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, kind_of, last_sgf local
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| H A D | qs_scf_post_se.F | 405 INTEGER, DIMENSION(:, :), POINTER :: first_sgf local
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| H A D | xas_methods.F | 597 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, kind_type_tmp, kind_z_tmp, & local
1505 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf local
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| H A D | qs_linres_issc_utils.F | 790 INTEGER, ALLOCATABLE, DIMENSION(:) :: first_sgf, last_sgf local
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| H A D | paw_proj_set_types.F | 253 INTEGER, DIMENSION(:, :), POINTER :: first_cgf, first_sgf, l, last_cgf, & local
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/aobasis/ |
| H A D | basis_set_types.F | 83 INTEGER, DIMENSION(:, :), POINTER :: first_cgf, first_sgf, l, & component
670 … m, ncgf_set, npgf, nsgf_set, nshell, cphi, pgf_radius, sphi, scon, zet, first_cgf, first_sgf, l, & argument
690 INTEGER, DIMENSION(:, :), OPTIONAL, POINTER :: first_cgf, first_sgf, l, last_cgf, & local
860 … INTEGER :: first_cgf, first_sgf, handle, icgf, ico, & local
1874 cphi, pgf_radius, sphi, scon, zet, first_cgf, first_sgf, l, & argument
1893 INTEGER, DIMENSION(:, :), OPTIONAL, POINTER :: first_cgf, first_sgf, l, last_cgf, & local
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| /dports/science/cp2k-data/cp2k-7.1.0/src/aobasis/ |
| H A D | basis_set_types.F | 79 INTEGER, DIMENSION(:, :), POINTER :: first_cgf, first_sgf, l, & component
665 … m, ncgf_set, npgf, nsgf_set, nshell, cphi, pgf_radius, sphi, scon, zet, first_cgf, first_sgf, l, & argument
685 INTEGER, DIMENSION(:, :), OPTIONAL, POINTER :: first_cgf, first_sgf, l, last_cgf, & local
855 … INTEGER :: first_cgf, first_sgf, handle, icgf, ico, & local
1861 cphi, pgf_radius, sphi, scon, zet, first_cgf, first_sgf, l, & argument
1880 INTEGER, DIMENSION(:, :), OPTIONAL, POINTER :: first_cgf, first_sgf, l, last_cgf, & local
|