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

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqs_ks_utils.F704 SUBROUTINE calc_v_sic_rspace(v_sic_rspace, energy, & argument
708 TYPE(pw_p_type), INTENT(INOUT) :: v_sic_rspace local
813 CALL pw_pool_create_pw(auxbas_pw_pool, v_sic_rspace%pw, &
815 CALL pw_transfer(work_v%pw, v_sic_rspace%pw)
817 CALL pw_scale(v_sic_rspace%pw, &
818 dft_control%sic_scaling_a*v_sic_rspace%pw%pw_grid%dvol)
1198 v_sic_rspace, v_spin_ddapc_rest_r, & argument
1209 TYPE(pw_p_type) :: v_efield_rspace, v_sic_rspace, & local
1380 v_sic_rspace%pw%cr3d
1383 v_sic_rspace%pw%cr3d
[all …]
H A Dqs_ks_methods.F168 vppl_rspace, v_sic_rspace, v_spin_ddapc_rest_r component
235 v_minus_veps, v_sccs_rspace, v_sic_rspace, v_spin_ddapc_rest_r local
468 CALL calc_v_sic_rspace(v_sic_rspace, energy, qs_env, dft_control, rho, poisson_env, &
691 … v_efield_rspace, v_sic_rspace, v_spin_ddapc_rest_r, v_sccs_rspace, v_rspace_embed, &
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqs_ks_utils.F706 SUBROUTINE calc_v_sic_rspace(v_sic_rspace, energy, & argument
710 TYPE(pw_p_type), INTENT(INOUT) :: v_sic_rspace local
815 CALL pw_pool_create_pw(auxbas_pw_pool, v_sic_rspace%pw, &
817 CALL pw_transfer(work_v%pw, v_sic_rspace%pw)
819 CALL pw_scale(v_sic_rspace%pw, &
820 dft_control%sic_scaling_a*v_sic_rspace%pw%pw_grid%dvol)
1204 v_sic_rspace, v_spin_ddapc_rest_r, & argument
1215 TYPE(pw_p_type) :: v_efield_rspace, v_sic_rspace, & local
1388 v_sic_rspace%pw%cr3d
1391 v_sic_rspace%pw%cr3d
[all …]
H A Dqs_ks_methods.F171 vppl_rspace, v_sic_rspace, v_spin_ddapc_rest_r component
240 v_minus_veps, v_sccs_rspace, v_sic_rspace, v_spin_ddapc_rest_r local
474 CALL calc_v_sic_rspace(v_sic_rspace, energy, qs_env, dft_control, rho, poisson_env, &
706 … v_efield_rspace, v_sic_rspace, v_spin_ddapc_rest_r, v_sccs_rspace, v_rspace_embed, &