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Searched refs:cdft_constraint_section (Results 1 – 4 of 4) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqs_cdft_utils.F133 TYPE(section_vals_type), POINTER :: cdft_constraint_section local
136 particle_set, logger, cdft_constraint_section, qs_kind_set, &
147 cdft_constraint_section => section_vals_get_subs_vals(qs_env%input, "DFT%QS%CDFT")
431 unit_nr = cp_print_key_unit_nr(logger, cdft_constraint_section, "PROGRAM_RUN_INFO", &
1126 TYPE(section_vals_type), POINTER :: cdft_constraint_section local
1128 NULLIFY (cdft_constraint_section, logger, particle_set, dft_control, qs_kind_set)
1137 cdft_constraint_section => section_vals_get_subs_vals(qs_env%input, "DFT%QS%CDFT")
1291 TYPE(section_vals_type), POINTER :: cdft_constraint_section local
1293 NULLIFY (cdft_constraint_section, logger, particles, dft_control, &
1300 cdft_constraint_section => section_vals_get_subs_vals(qs_env%input, "DFT%QS%CDFT")
[all …]
H A Dqs_cdft_methods.F799 TYPE(section_vals_type), POINTER :: cdft_constraint_section local
802 logger, cdft_constraint_section, qs_kind_set, mp_rho, &
815 cdft_constraint_section => section_vals_get_subs_vals(qs_env%input, "DFT%QS%CDFT")
816 …iw = cp_print_key_unit_nr(logger, cdft_constraint_section, "PROGRAM_RUN_INFO", extension=".cdftLog…
954 CALL cp_print_key_finished_output(iw, logger, cdft_constraint_section, "PROGRAM_RUN_INFO")
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqs_cdft_utils.F132 TYPE(section_vals_type), POINTER :: cdft_constraint_section local
135 particle_set, logger, cdft_constraint_section, qs_kind_set, &
146 cdft_constraint_section => section_vals_get_subs_vals(qs_env%input, "DFT%QS%CDFT")
425 unit_nr = cp_print_key_unit_nr(logger, cdft_constraint_section, "PROGRAM_RUN_INFO", &
1120 TYPE(section_vals_type), POINTER :: cdft_constraint_section local
1122 NULLIFY (cdft_constraint_section, logger, particle_set, dft_control, qs_kind_set)
1131 cdft_constraint_section => section_vals_get_subs_vals(qs_env%input, "DFT%QS%CDFT")
1285 TYPE(section_vals_type), POINTER :: cdft_constraint_section local
1287 NULLIFY (cdft_constraint_section, logger, particles, dft_control, &
1294 cdft_constraint_section => section_vals_get_subs_vals(qs_env%input, "DFT%QS%CDFT")
[all …]
H A Dqs_cdft_methods.F798 TYPE(section_vals_type), POINTER :: cdft_constraint_section local
801 logger, cdft_constraint_section, qs_kind_set, mp_rho, &
814 cdft_constraint_section => section_vals_get_subs_vals(qs_env%input, "DFT%QS%CDFT")
815 …iw = cp_print_key_unit_nr(logger, cdft_constraint_section, "PROGRAM_RUN_INFO", extension=".cdftLog…
953 CALL cp_print_key_finished_output(iw, logger, cdft_constraint_section, "PROGRAM_RUN_INFO")