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Searched refs:matrix_ia_jnu (Results 1 – 4 of 4) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dmp2_integrals.F272 matrix_ia_jb, matrix_ia_jb_beta, matrix_ia_jnu, matrix_ia_jnu_beta, matrix_in_jm, & local
333 CALL create_intermediate_matrices(matrix_ia_jnu, matrix_ia_jb, mo_coeff_o, virtual, homo, &
683 CALL ao_to_mo_and_store_B(para_env_sub, mat_munu, matrix_ia_jnu, matrix_ia_jb, &
728 CALL dbcsr_release(matrix_ia_jnu)
1190 TYPE(dbcsr_type), INTENT(OUT) :: matrix_ia_jnu, matrix_ia_jb local
1211 CALL dbcsr_create(matrix_ia_jnu, template=mo_coeff_templ)
1218 CALL dbcsr_set(matrix_ia_jnu, 0.0_dp)
1272 …SUBROUTINE ao_to_mo_and_store_B(para_env, mat_munu, matrix_ia_jnu, matrix_ia_jb, fm_BIb_jb, BIb_jb… argument
1278 TYPE(dbcsr_type), INTENT(INOUT) :: matrix_ia_jnu, matrix_ia_jb local
1296 0.0_dp, matrix_ia_jnu, filter_eps=eps_filter)
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H A Dmp2_gpw_method.F168 matrix_ia_jnu, matrix_ia_jnu_beta local
188 CALL dbcsr_create(matrix_ia_jnu, template=mo_coeff_o)
195 CALL dbcsr_set(matrix_ia_jnu, 0.0_dp)
462 0.0_dp, matrix_ia_jnu, filter_eps=eps_filter)
470 CALL dbcsr_multiply("T", "N", 1.0_dp, matrix_ia_jnu, mo_coeff_v, &
599 CALL dbcsr_release(matrix_ia_jnu)
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dmp2_gpw_method.F168 matrix_ia_jnu, matrix_ia_jnu_beta local
188 CALL dbcsr_create(matrix_ia_jnu, template=mo_coeff_o)
195 CALL dbcsr_set(matrix_ia_jnu, 0.0_dp)
462 0.0_dp, matrix_ia_jnu, filter_eps=eps_filter)
470 CALL dbcsr_multiply("T", "N", 1.0_dp, matrix_ia_jnu, mo_coeff_v, &
599 CALL dbcsr_release(matrix_ia_jnu)
H A Dmp2_integrals.F306 matrix_ia_jb, matrix_ia_jb_beta, matrix_ia_jnu, matrix_ia_jnu_beta, matrix_in_jm, & local
368 CALL create_intermediate_matrices(matrix_ia_jnu, matrix_ia_jb, mo_coeff_o, virtual, homo, &
686 CALL ao_to_mo_and_store_B(para_env_sub, mat_munu, matrix_ia_jnu, matrix_ia_jb, &
731 CALL dbcsr_release(matrix_ia_jnu)
1329 TYPE(dbcsr_type), INTENT(OUT) :: matrix_ia_jnu, matrix_ia_jb local
1350 CALL dbcsr_create(matrix_ia_jnu, template=mo_coeff_templ)
1357 CALL dbcsr_set(matrix_ia_jnu, 0.0_dp)
1411 …SUBROUTINE ao_to_mo_and_store_B(para_env, mat_munu, matrix_ia_jnu, matrix_ia_jb, fm_BIb_jb, BIb_jb… argument
1417 TYPE(dbcsr_type), INTENT(INOUT) :: matrix_ia_jnu, matrix_ia_jb local
1435 0.0_dp, matrix_ia_jnu, filter_eps=eps_filter)
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