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Searched defs:print_wannier_centers (Results 1 – 2 of 2) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqs_loc_methods.F972 SUBROUTINE print_wannier_centers(qs_loc_env, print_key, center, logger, ispin) subroutine
979 CHARACTER(len=*), PARAMETER :: routineN = 'print_wannier_centers', & argument
980 routineP = moduleN//':'//routineN
982 CHARACTER(default_string_length) :: iter, unit_str
983 CHARACTER(LEN=default_string_length) :: my_ext, my_form
984 INTEGER :: iunit, l, nstates
985 LOGICAL :: first_time, init_traj
986 REAL(KIND=dp) :: unit_conv
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqs_loc_methods.F963 SUBROUTINE print_wannier_centers(qs_loc_env, print_key, center, logger, ispin) subroutine
970 CHARACTER(len=*), PARAMETER :: routineN = 'print_wannier_centers', & argument
971 routineP = moduleN//':'//routineN
973 CHARACTER(default_string_length) :: iter, unit_str
974 CHARACTER(LEN=default_string_length) :: my_ext, my_form
975 INTEGER :: iunit, l, nstates
976 LOGICAL :: first_time, init_traj
977 REAL(KIND=dp) :: unit_conv