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subroutine, public | mp2_grids::get_minimax_grid (para_env, unit_nr, homo, Eigenval, num_integ_points, do_im_time, do_ri_sos_laplace_mp2, do_print, tau_tj, tau_wj, qs_env, do_gw_im_time, do_kpoints_cubic_RPA, e_fermi, tj, wj, weights_cos_tf_t_to_w, weights_cos_tf_w_to_t, weights_sin_tf_t_to_w, regularization) |
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subroutine, public | mp2_grids::get_clenshaw_grid (para_env, para_env_RPA, unit_nr, homo, virtual, Eigenval, num_integ_points, num_integ_group, color_rpa_group, fm_mat_S, my_do_gw, ext_scaling, a_scaling, tj, wj) |
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subroutine, public | mp2_grids::get_l_sq_wghts_cos_tf_t_to_w (num_integ_points, tau_tj, weights_cos_tf_t_to_w, omega_tj, E_min, E_max, max_error, num_points_per_magnitude, regularization) |
| Calculate integration weights for the tau grid (in dependency of the omega node) More...
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subroutine, public | mp2_grids::get_l_sq_wghts_sin_tf_t_to_w (num_integ_points, tau_tj, weights_sin_tf_t_to_w, omega_tj, E_min, E_max, max_error, num_points_per_magnitude, regularization) |
| Calculate integration weights for the tau grid (in dependency of the omega node) More...
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subroutine, public | mp2_grids::test_least_square_ft (nR, iw) |
| test the singular value decomposition for the computation of integration weights for the Fourier transform between time and frequency grid in cubic-scaling RPA More...
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subroutine, public | mp2_grids::get_l_sq_wghts_cos_tf_w_to_t (num_integ_points, tau_tj, weights_cos_tf_w_to_t, omega_tj, E_min, E_max, max_error, num_points_per_magnitude, regularization) |
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