| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | bse.F | 57 B_iaQ_bse_local, homo, virtual, num_Z_vectors, & argument
88 local_RI_size = SIZE(B_iaQ_bse_local, 3)
107 CALL compute_BZ(BZ, Z_vectors, B_iaQ_bse_local, B_bar_iaQ_bse_local, &
133 SUBROUTINE compute_BZ(BZ, Z_vectors, B_iaQ_bse_local, B_bar_iaQ_bse_local, & argument
136 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: BZ, Z_vectors, B_iaQ_bse_local, & local
149 CALL compute_v_ia_jb_part(BZ, Z_vectors, B_iaQ_bse_local, RI_vector, local_RI_size, &
158 B_iaQ_bse_local(:, :, LLL), homo, 0.0_dp, M_ji_tmp, homo)
208 CALL compute_v_ia_jb_part(AZ, Z_vectors, B_iaQ_bse_local, RI_vector, local_RI_size, &
260 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: AZ, Z_vectors, B_iaQ_bse_local local
282 B_iaQ_bse_local(i_occ, a_virt, LLL)
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| H A D | rpa_main.F | 1348 B_bar_ijQ_bse_local, B_iaQ_bse_local local
1977 … B_iaQ_bse_local, dimen_RI_red, homo, virtual, dimen_ia, &
1981 B_iaQ_bse_local, homo, virtual, num_Z_vectors, &
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | bse.F | 57 B_iaQ_bse_local, homo, virtual, num_Z_vectors, & argument
88 local_RI_size = SIZE(B_iaQ_bse_local, 3)
107 CALL compute_BZ(BZ, Z_vectors, B_iaQ_bse_local, B_bar_iaQ_bse_local, &
133 SUBROUTINE compute_BZ(BZ, Z_vectors, B_iaQ_bse_local, B_bar_iaQ_bse_local, & argument
136 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: BZ, Z_vectors, B_iaQ_bse_local, & local
149 CALL compute_v_ia_jb_part(BZ, Z_vectors, B_iaQ_bse_local, RI_vector, local_RI_size, &
158 B_iaQ_bse_local(:, :, LLL), homo, 0.0_dp, M_ji_tmp, homo)
208 CALL compute_v_ia_jb_part(AZ, Z_vectors, B_iaQ_bse_local, RI_vector, local_RI_size, &
260 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: AZ, Z_vectors, B_iaQ_bse_local local
282 B_iaQ_bse_local(i_occ, a_virt, LLL)
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| H A D | rpa_main.F | 1489 B_bar_ijQ_bse_local, B_iaQ_bse_local local
2190 … B_iaQ_bse_local, dimen_RI_red, homo, virtual, dimen_ia, &
2194 B_iaQ_bse_local, homo, virtual, num_Z_vectors, &
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