#include <cmath>#include <utility>#include <vector>#include "io/logger.hpp"#include "layer_0_core/math/tolerances.hpp"#include "layer_0_core/types/matrix.hpp"#include "layer_1_structure/crystal/crystal.hpp"#include "layer_1_structure/reciprocal_space/kpoints_grid.hpp"#include "layer_1_structure/symmetry/symmetry.hpp"#include "layer_3_representation/basis/planewave/init.hpp"#include "layer_3_representation/quantum_system/kohn_sham/planewave/norm_conserving/init.hpp"#include "layer_4_computation/effective_potential/internal/dispersion/factory.hpp"#include "layer_4_computation/state/kohn_sham/planewave/norm_conserving/init.hpp"#include "layer_5_properties/forces/planewave/contributions.hpp"#include "layer_5_properties/forces/planewave/internal/ewald.hpp"#include "layer_5_properties/forces/planewave/pseudopotential/init.hpp"Go to the source code of this file.
Classes | |
| struct | q3::ForceCalculator |
| Compute Hellmann-Feynman forces on all atoms. More... | |
Namespaces | |
| namespace | q3 |