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(git:4a2d255)
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Functions/Subroutines | |
| subroutine, public | rescale_xc_potential (qs_env, ks_matrix, rho, energy, v_rspace_new, v_tau_rspace, hf_energy, just_energy, calculate_forces, use_virial) |
| subroutine, public xc_adiabatic_utils::rescale_xc_potential | ( | type(qs_environment_type), pointer | qs_env, |
| type(dbcsr_p_type), dimension(:, :), pointer | ks_matrix, | ||
| type(qs_rho_type), pointer | rho, | ||
| type(qs_energy_type), pointer | energy, | ||
| type(pw_r3d_rs_type), dimension(:), pointer | v_rspace_new, | ||
| type(pw_r3d_rs_type), dimension(:), pointer | v_tau_rspace, | ||
| real(dp), dimension(:) | hf_energy, | ||
| logical, intent(in) | just_energy, | ||
| logical, intent(in) | calculate_forces, | ||
| logical, intent(in) | use_virial | ||
| ) |
| qs_env | ... |
| ks_matrix | ... |
| rho | ... |
| energy | ... |
| v_rspace_new | ... |
| v_tau_rspace | ... |
| hf_energy | ... |
| just_energy | ... |
| calculate_forces | ... |
| use_virial | ... |
Definition at line 68 of file xc_adiabatic_utils.F.