Searched refs:G_P_munu_nosym (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | mp2_ri_grad.F | 1014 SUBROUTINE G_P_transform_MO_to_AO(G_P_munu, G_P_munu_nosym, mat_munu, G_P_ia, G_P_inu, & argument
1017 TYPE(dbcsr_p_type), INTENT(INOUT) :: G_P_munu, G_P_munu_nosym, mat_munu local
1034 CALL dbcsr_set(G_P_munu_nosym%matrix, 0.0_dp)
1035 …CALL G_P_transform_alpha_beta(G_P_ia, G_P_inu, G_P_munu_nosym, mo_coeff_v, mo_coeff_o, [1.0_dp, 0.…
1038 …CALL G_P_transform_alpha_beta(G_P_ia_beta, G_P_inu_beta, G_P_munu_nosym, mo_coeff_v_beta, mo_coeff…
1045 CALL dbcsr_transposed(G_P_munu%matrix, G_P_munu_nosym%matrix)
1046 CALL dbcsr_add(G_P_munu%matrix, G_P_munu_nosym%matrix, &
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | mp2_ri_grad.F | 1007 SUBROUTINE G_P_transform_MO_to_AO(G_P_munu, G_P_munu_nosym, mat_munu, G_P_ia, G_P_inu, & argument
1010 TYPE(dbcsr_p_type), INTENT(INOUT) :: G_P_munu, G_P_munu_nosym, mat_munu local
1027 CALL dbcsr_set(G_P_munu_nosym%matrix, 0.0_dp)
1028 …CALL G_P_transform_alpha_beta(G_P_ia, G_P_inu, G_P_munu_nosym, mo_coeff_v, mo_coeff_o, [1.0_dp, 0.…
1031 …CALL G_P_transform_alpha_beta(G_P_ia_beta, G_P_inu_beta, G_P_munu_nosym, mo_coeff_v_beta, mo_coeff…
1038 CALL dbcsr_transposed(G_P_munu%matrix, G_P_munu_nosym%matrix)
1039 CALL dbcsr_add(G_P_munu%matrix, G_P_munu_nosym%matrix, &
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