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

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dpao_methods.F557 SUBROUTINE pao_read_preopt_dm(pao, qs_env) subroutine
561 CHARACTER(len=*), PARAMETER :: routineN = 'pao_read_preopt_dm', & argument
562 routineP = moduleN//':'//routineN
564 INTEGER :: handle, ispin
565 REAL(KIND=dp) :: cs_pos
566 TYPE(dbcsr_distribution_type) :: dist
567 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: matrix_s, rho_ao
568 TYPE(dbcsr_type) :: matrix_tmp
569 TYPE(dft_control_type), POINTER :: dft_control
570 TYPE(qs_energy_type), POINTER :: energy
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dpao_methods.F557 SUBROUTINE pao_read_preopt_dm(pao, qs_env) subroutine
561 CHARACTER(len=*), PARAMETER :: routineN = 'pao_read_preopt_dm', & argument
562 routineP = moduleN//':'//routineN
564 INTEGER :: handle, ispin
565 REAL(KIND=dp) :: cs_pos
566 TYPE(dbcsr_distribution_type) :: dist
567 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: matrix_s, rho_ao
568 TYPE(dbcsr_type) :: matrix_tmp
569 TYPE(dft_control_type), POINTER :: dft_control
570 TYPE(qs_energy_type), POINTER :: energy
[all …]