Searched defs:scf_post_calculation_se (Results 1 – 2 of 2) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | qs_scf_post_se.F | 90 SUBROUTINE scf_post_calculation_se(qs_env) subroutine 94 CHARACTER(len=*), PARAMETER :: routineN = 'scf_post_calculation_se', & argument 95 routineP = moduleN//':'//routineN 97 INTEGER :: handle, output_unit 98 LOGICAL :: explicit, my_localized_wfn 99 TYPE(cp_logger_type), POINTER :: logger 100 TYPE(cp_para_env_type), POINTER :: para_env 102 TYPE(mo_set_p_type), DIMENSION(:), POINTER :: mos 104 TYPE(qs_rho_type), POINTER :: rho 105 TYPE(qs_subsys_type), POINTER :: subsys [all …]
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | qs_scf_post_se.F | 90 SUBROUTINE scf_post_calculation_se(qs_env) subroutine 94 CHARACTER(len=*), PARAMETER :: routineN = 'scf_post_calculation_se', & argument 95 routineP = moduleN//':'//routineN 97 INTEGER :: handle, output_unit 98 LOGICAL :: explicit, my_localized_wfn 99 TYPE(cp_logger_type), POINTER :: logger 100 TYPE(cp_para_env_type), POINTER :: para_env 102 TYPE(mo_set_p_type), DIMENSION(:), POINTER :: mos 104 TYPE(qs_rho_type), POINTER :: rho 105 TYPE(qs_subsys_type), POINTER :: subsys [all …]
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