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Searched refs:mat_3c_overl_int_mao_for_virt (Results 1 – 4 of 4) sorted by relevance

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Drpa_util.F183 … mat_3c_overl_int, mat_3c_overl_int_mao_for_occ, mat_3c_overl_int_mao_for_virt, do_dbcsr_t, & argument
214 mat_3c_overl_int_mao_for_virt local
352 mat_3c_overl_int_mao_for_virt => mat_3c_overl_int
357 …te_mat_M_P_munu(mat_M_P_munu_virt, mat_M, mat_M_mu_Pnu_virt, cut_RI, mat_3c_overl_int_mao_for_virt)
926mat_3c_overl_int_mao_for_virt, do_dbcsr_t, eps_filter, cut_RI, & argument
936 mat_3c_overl_int_mao_for_virt local
974 … CALL setup_mat_for_mem_cut_3c(mat_3c_overl_int_mao_for_virt_cut, mat_3c_overl_int_mao_for_virt, &
H A Drpa_main.F183 mat_3c_overl_int_mao_for_virt, & argument
219 mat_3c_overl_int_mao_for_virt local
677 … mat_3c_overl_int, mat_3c_overl_int_mao_for_occ, mat_3c_overl_int_mao_for_virt, &
701 … mat_3c_overl_int, mat_3c_overl_int_mao_for_occ, mat_3c_overl_int_mao_for_virt, &
1389 mat_3c_overl_int_mao_for_virt, & argument
1424 mat_3c_overl_int_mao_for_virt local
1588 … mat_3c_overl_int, mat_3c_overl_int_mao_for_occ, mat_3c_overl_int_mao_for_virt, do_dbcsr_t, &
1656mat_3c_overl_int_mao_for_virt, do_dbcsr_t, eps_filter, cut_RI, &
H A Dmp2_integrals.F216 mat_3c_overl_int_mao_for_virt, mao_coeff_occ, mao_coeff_virt, & argument
260 mat_3c_overl_int_mao_for_virt local
907 … CALL reserve_blocks_3c(mat_3c_overl_int_mao_for_virt, mat_munu_mao_virt_occ, qs_env, &
921 mat_3c_overl_int_mao_for_virt, &
1812mat_3c_overl_int_mao_for_virt, mat_munu, mat_munu_mao_occ_virt, & argument
1820 mat_3c_overl_int_mao_for_virt local
2407 … CALL dbcsr_put_block(mat_3c_overl_int_mao_for_virt(i_cut_RI, i_img, j_img)%matrix, &
2419 … CALL dbcsr_put_block(mat_3c_overl_int_mao_for_virt(i_cut_RI, j_img, i_img)%matrix, &
H A Dmp2_gpw.F198 mat_3c_overl_int_mao_for_virt local
459 mat_3c_overl_int_mao_for_occ, mat_3c_overl_int_mao_for_virt, &
479mat_3c_overl_int_mao_for_virt, mao_coeff_occ, mao_coeff_virt, &
645 mat_3c_overl_int_mao_for_occ, mat_3c_overl_int_mao_for_virt, &
666 mat_3c_overl_int_mao_for_occ, mat_3c_overl_int_mao_for_virt, &