Searched defs:qs_loc_init (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | qs_loc_utils.F | 1232 CHARACTER(len=*), PARAMETER :: routineN = 'qs_loc_init', routineP = moduleN//':'//routineN argument
1234 INTEGER :: handle, homo, i, ilast_intocc, ilow, &
1235 ispin, iup, n_mo(2), n_mos(2), nao, &
1236 nelectron, nmoloc(2), nspin, &
1238 … LOGICAL :: my_do_homo, my_do_mo_cubes, restart_found
1239 REAL(KIND=dp), DIMENSION(:), POINTER :: mo_eigenvalues, occupation
1240 TYPE(cp_fm_type), POINTER :: mo_coeff
1241 TYPE(cp_logger_type), POINTER :: logger
1242 TYPE(cp_para_env_type), POINTER :: para_env
1243 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: ks_rmpv, mo_derivs
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | qs_loc_utils.F | 1260 CHARACTER(len=*), PARAMETER :: routineN = 'qs_loc_init', routineP = moduleN//':'//routineN argument
1262 INTEGER :: handle, homo, i, ilast_intocc, ilow, &
1263 ispin, iup, n_mo(2), n_mos(2), nao, &
1264 nelectron, nmoloc(2), nspin, &
1266 … LOGICAL :: my_do_homo, my_do_mo_cubes, restart_found
1267 REAL(KIND=dp), DIMENSION(:), POINTER :: mo_eigenvalues, occupation
1268 TYPE(cp_fm_type), POINTER :: mo_coeff
1269 TYPE(cp_logger_type), POINTER :: logger
1270 TYPE(cp_para_env_type), POINTER :: para_env
1271 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: ks_rmpv, mo_derivs
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