Searched refs:vh_rspace (Results 1 – 4 of 4) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | ec_env_types.F | 89 TYPE(pw_p_type), POINTER :: vh_rspace component 149 IF (ASSOCIATED(ec_env%vh_rspace)) THEN 150 CALL pw_release(ec_env%vh_rspace%pw) 151 DEALLOCATE (ec_env%vh_rspace)
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H A D | response_solver.F | 302 SUBROUTINE response_force(qs_env, p_env, vh_rspace, vxc_rspace, vtau_rspace, matrix_hz) argument 305 TYPE(pw_p_type), POINTER :: vh_rspace local 467 CALL pw_transfer(vh_rspace%pw, vhxc_rspace%pw) 1104 SUBROUTINE ks_ref_potential(qs_env, vh_rspace, vxc_rspace, vtau_rspace, ehartree, exc) argument 1106 TYPE(pw_p_type), POINTER :: vh_rspace local 1184 IF (ASSOCIATED(vh_rspace)) THEN 1185 CALL pw_release(vh_rspace%pw) 1187 ALLOCATE (vh_rspace) 1188 NULLIFY (vh_rspace%pw) 1216 CALL pw_create(vh_rspace%pw, pw_grid, use_data=REALDATA3D, in_space=REALSPACE) [all …]
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H A D | ec_environment.F | 118 NULLIFY (ec_env%vh_rspace)
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H A D | energy_corrections.F | 314 CALL ks_ref_potential(qs_env, ec_env%vh_rspace, ec_env%vxc_rspace, ec_env%vtau_rspace, & 340 ec_env%vh_rspace, ec_env%vxc_rspace, ec_env%vtau_rspace, & 560 CALL pw_axpy(ec_env%vh_rspace%pw, v_rspace(ispin)%pw) 856 CALL pw_transfer(ec_env%vh_rspace%pw, v_hartree_rspace%pw)
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