Searched defs:write_kpoints_restart (Results 1 – 2 of 2) sorted by relevance
/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | kpoint_io.F | 73 SUBROUTINE write_kpoints_restart(denmat, kpoints, scf_env, dft_section, & subroutine 83 CHARACTER(LEN=*), PARAMETER :: routineN = 'write_kpoints_restart', & argument 84 routineP = moduleN//':'//routineN 86 keys = (/"SCF%PRINT%RESTART_HISTORY", "SCF%PRINT%RESTART "/) 88 … INTEGER :: handle, ic, ikey, ires, ispin, nimages, & 89 nspin 90 INTEGER, DIMENSION(3) :: cell 91 INTEGER, DIMENSION(:, :, :), POINTER :: cell_to_index 92 TYPE(cp_fm_type), POINTER :: fmat 93 TYPE(cp_logger_type), POINTER :: logger
|
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | kpoint_io.F | 73 SUBROUTINE write_kpoints_restart(denmat, kpoints, scf_env, dft_section, & subroutine 83 CHARACTER(LEN=*), PARAMETER :: routineN = 'write_kpoints_restart', & argument 84 routineP = moduleN//':'//routineN 86 keys = (/"SCF%PRINT%RESTART_HISTORY", "SCF%PRINT%RESTART "/) 88 … INTEGER :: handle, ic, ikey, ires, ispin, nimages, & 89 nspin 90 INTEGER, DIMENSION(3) :: cell 91 INTEGER, DIMENSION(:, :, :), POINTER :: cell_to_index 92 TYPE(cp_fm_type), POINTER :: fmat 93 TYPE(cp_logger_type), POINTER :: logger
|