Searched refs:Z_vectors (Results 1 – 2 of 2) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | bse.F | 72 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: AZ, BZ, Z_vectors local 79 ALLOCATE (Z_vectors(homo, virtual, num_Z_vectors)) 80 Z_vectors = 0.0_dp 99 CALL initial_guess_Z_vectors(Z_vectors, Eigenval, num_Z_vectors, homo, virtual) 107 CALL compute_BZ(BZ, Z_vectors, B_iaQ_bse_local, B_bar_iaQ_bse_local, & 113 DEALLOCATE (AZ, BZ, Z_vectors, M_ia_tmp, M_ji_tmp, RI_vector) 133 SUBROUTINE compute_BZ(BZ, Z_vectors, B_iaQ_bse_local, B_bar_iaQ_bse_local, & argument 281 Z_vectors(i_occ, a_virt, i_Z_vector)* & 316 SUBROUTINE initial_guess_Z_vectors(Z_vectors, Eigenval, num_Z_vectors, homo, virtual) argument 318 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: Z_vectors local [all …]
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | bse.F | 72 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: AZ, BZ, Z_vectors local 79 ALLOCATE (Z_vectors(homo, virtual, num_Z_vectors)) 80 Z_vectors = 0.0_dp 99 CALL initial_guess_Z_vectors(Z_vectors, Eigenval, num_Z_vectors, homo, virtual) 107 CALL compute_BZ(BZ, Z_vectors, B_iaQ_bse_local, B_bar_iaQ_bse_local, & 113 DEALLOCATE (AZ, BZ, Z_vectors, M_ia_tmp, M_ji_tmp, RI_vector) 133 SUBROUTINE compute_BZ(BZ, Z_vectors, B_iaQ_bse_local, B_bar_iaQ_bse_local, & argument 281 Z_vectors(i_occ, a_virt, i_Z_vector)* & 316 SUBROUTINE initial_guess_Z_vectors(Z_vectors, Eigenval, num_Z_vectors, homo, virtual) argument 318 REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: Z_vectors local [all …]
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