init.hpp File Reference

#include <algorithm>
#include <chrono>
#include <memory>
#include <stdexcept>
#include <string>
#include <vector>
#include "io/logger.hpp"
#include "io/quantum_system/kohn_sham/init.hpp"
#include "layer_0_core/execution/init.hpp"
#include "layer_0_core/math/tolerances.hpp"
#include "layer_0_core/profiling/counters.hpp"
#include "layer_0_core/types/init.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_3_representation/pseudopotential/set.hpp"
#include "layer_4_computation/effective_potential/internal/exchange_correlation/factory.hpp"
#include "layer_4_computation/effective_potential/internal/hubbard/hubbard.hpp"
#include "layer_4_computation/iterator/init.hpp"
#include "layer_4_computation/iterator/internal/mixing/factory.hpp"
#include "layer_4_computation/iterator/internal/mixing/init.hpp"
#include "layer_4_computation/iterator/internal/mixing/preconditioner/factory.hpp"
#include "layer_4_computation/iterator/internal/smearing/factory.hpp"
#include "layer_4_computation/iterator/internal/smearing/init.hpp"
#include "layer_4_computation/state/internal/energies/kohn_sham/init.hpp"

Go to the source code of this file.

Classes
class	q3::KohnShamSCFIterator
struct	q3::KohnShamSCFIteratorConfig
struct	q3::KohnShamSCFIterator::ScfIterationRecord
	One row per SCF iteration, in order; the source for per-iteration companion outputs. More...

Namespaces
namespace	q3