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Searched refs:matrix_M_diag (Results 1 – 2 of 2) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dpao_methods.F683 SUBROUTINE pao_calc_outer_grad_lnv(qs_env, ls_scf_env, matrix_M_diag) argument
686 TYPE(dbcsr_type) :: matrix_M_diag local
871 CALL dbcsr_create(matrix_M_diag, &
876 CALL dbcsr_reserve_diag_blocks(matrix_M_diag)
877 CALL dbcsr_complete_redistribute(matrix_M, matrix_M_diag)
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dpao_methods.F683 SUBROUTINE pao_calc_outer_grad_lnv(qs_env, ls_scf_env, matrix_M_diag) argument
686 TYPE(dbcsr_type) :: matrix_M_diag local
871 CALL dbcsr_create(matrix_M_diag, &
876 CALL dbcsr_reserve_diag_blocks(matrix_M_diag)
877 CALL dbcsr_complete_redistribute(matrix_M, matrix_M_diag)