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Searched refs:eps_filter_im_time (Results 1 – 10 of 10) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Drpa_kpoints.F98 … mat_P_omega, mat_P_omega_kp, qs_env, eps_filter_im_time, kpoints, fm_mat_L, fm_mat_W, & argument
119 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time local
145 kpoints, eps_filter_im_time, jquad)
721 kpoints, eps_filter_im_time, jquad) argument
725 REAL(kind=dp), INTENT(IN) :: eps_filter_im_time local
741 kpoints, index_to_cell_dm, eps_filter_im_time)
762 kpoints, index_to_cell, eps_filter_im_time) argument
767 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time local
826 CALL dbcsr_filter(real_mat_kp(ik)%matrix, eps_filter_im_time)
827 CALL dbcsr_filter(imag_mat_kp(ik)%matrix, eps_filter_im_time)
H A Drpa_util.F134 t_3c_O, matrix_s, kpoints, eps_filter_im_time, & argument
160 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time local
341 0.0_dp, mat_SinvVSinv%matrix, filter_eps=eps_filter_im_time)
1193 …SUBROUTINE contract_P_omega_with_mat_L(mat_P_omega, mat_L, mat_work, eps_filter_im_time, fm_mat_wo… argument
1197 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time local
1211 0.0_dp, mat_work, filter_eps=eps_filter_im_time)
H A Drpa_main.F1340 eps_filter_im_time, eps_min_trans, ext_scaling, fermi_level_offset, & local
1439 eps_filter_im_time = mp2_env%ri_rpa_im_time%eps_filter* &
1447 t_3c_O, matrix_s, kpoints, eps_filter_im_time, &
1662 "SPARSITY_INFO| Eps filter for P matrix:", eps_filter_im_time
1680 eps_filter_im_time, Eigenval, nmo, &
1703 eps_filter_im_time, Eigenval_beta, nmo, &
1720 eps_filter_im_time, Eigenval_beta, nmo, &
1753 …ract_P_omega_with_mat_L(mat_P_omega(jquad, 1)%matrix, mat_L%matrix, mat_work, eps_filter_im_time, &
1759 … eps_filter_im_time, fm_mat_work, dimen_RI, dimen_RI_red, &
1817 … cfm_mat_Q, ikp_local, mat_P_omega, mat_P_omega_kp, qs_env, eps_filter_im_time, &
H A Drpa_im_time.F123 alpha, eps_filter_im_time, Eigenval, nmo, & argument
146 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time, alpha, eps_filter, & local
490 … filter_eps=eps_filter_im_time/REAL(cut_memory**2, KIND=dp), &
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Drpa_kpoints.F98 … mat_P_omega, mat_P_omega_kp, qs_env, eps_filter_im_time, kpoints, fm_mat_L, fm_mat_W_tau, & argument
119 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time local
145 kpoints, eps_filter_im_time, jquad)
721 kpoints, eps_filter_im_time, jquad) argument
725 REAL(kind=dp), INTENT(IN) :: eps_filter_im_time local
741 kpoints, index_to_cell_dm, eps_filter_im_time)
762 kpoints, index_to_cell, eps_filter_im_time) argument
767 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time local
826 CALL dbcsr_filter(real_mat_kp(ik)%matrix, eps_filter_im_time)
827 CALL dbcsr_filter(imag_mat_kp(ik)%matrix, eps_filter_im_time)
H A Drpa_im_time.F130 alpha, eps_filter_im_time, Eigenval, nmo, & argument
149 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time, alpha, eps_filter, & local
692 alpha, eps_filter_im_time, Eigenval, nmo, n_group_col, & argument
788 alpha, eps_filter_im_time, Eigenval, nmo, &
1016 eps_filter_im_time)
1708 eps_filter_im_time) argument
1713 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time local
1937 CALL dbcsr_filter(mat_P_global%matrix, eps_filter_im_time)
2678 i_mem, j_mem, buffer_mat_M, eps_filter_im_time, & argument
2695 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time local
[all …]
H A Drpa_main.F1480 eps_filter_im_time, eps_min_trans, ext_scaling, fermi_level_offset, my_flop_rate, omega, & local
1582 eps_filter_im_time = mp2_env%ri_rpa_im_time%eps_filter_im_time
1589 t_3c_O, matrix_s, kpoints, eps_filter, eps_filter_im_time, &
1824 "SPARSITY_INFO| Second eps filter for imaginary time:", eps_filter_im_time
1842 eps_filter_im_time, Eigenval, nmo, n_group_col, &
1877 eps_filter_im_time, Eigenval_beta, nmo, n_group_col, &
1906 eps_filter_im_time, Eigenval_beta, nmo, n_group_col, &
1949 …ract_P_omega_with_mat_L(mat_P_omega(jquad, 1)%matrix, mat_L%matrix, mat_work, eps_filter_im_time, &
1955 … eps_filter_im_time, fm_mat_work, dimen_RI, dimen_RI_red, &
2011 … cfm_mat_Q, ikp_local, mat_P_omega, mat_P_omega_kp, qs_env, eps_filter_im_time, &
H A Drpa_util.F184 t_3c_O, matrix_s, kpoints, eps_filter, eps_filter_im_time, & argument
220 REAL(KIND=dp), INTENT(IN) :: eps_filter, eps_filter_im_time local
597 0.0_dp, mat_SinvVSinv%matrix, filter_eps=eps_filter_im_time)
2017 …SUBROUTINE contract_P_omega_with_mat_L(mat_P_omega, mat_L, mat_work, eps_filter_im_time, fm_mat_wo… argument
2021 REAL(KIND=dp), INTENT(IN) :: eps_filter_im_time local
2035 0.0_dp, mat_work, filter_eps=eps_filter_im_time)
H A Dmp2_types.F138 …REAL(KIND=dp) :: eps_filter_im_time, eps_grad_occ, eps_grad_virt, lr_fraction, cutoff, & component
H A Dmp2_setup.F322 r_val=mp2_env%ri_rpa_im_time%eps_filter_im_time)