test_state_archive_hdf5.cpp File Reference

#include "../solvers/fd_save_load.hpp"
#include "../solvers/response_state.hpp"
#include <madness/mra/mra.h>
#include <algorithm>
#include <cstdio>
#include <cstdlib>
#include <filesystem>
#include <fstream>
#include <stdexcept>
#include <vector>

Include dependency graph for test_state_archive_hdf5.cpp:

Functions
static double	g0 (const Vector< double, D > &r)
static double	g1 (const Vector< double, D > &r)
static double	g2 (const Vector< double, D > &r)
int	main (int argc, char **argv)
static double	state_max_err (const ResponseStateX< ClosedShell > &a, const ResponseStateX< ClosedShell > &b)
static double	statexy_max_err (const ResponseStateXY< ClosedShell > &a, const ResponseStateXY< ClosedShell > &b)

Variables
static const std::size_t	D = 3

Function Documentation

g0()

double g0 ( const Vector< double, D > & r )

static

Referenced by madness::load_coeffs(), main(), plotter1(), plotter2(), plotter3(), madness::read_twoscale(), test_XCOperator_matrix(), madness::two_scale_coefficients(), and madness::two_scale_hg().

g1()

double g1 ( const Vector< double, D > & r )

static

Referenced by madness::FunctionImpl< T, NDIM >::multiply_op< LDIM >::multiply_op(), madness::FunctionImpl< T, NDIM >::add_op::activate(), madness::FunctionImpl< T, NDIM >::multiply_op< LDIM >::activate(), madness::FunctionImpl< T, NDIM >::project_out_op< LDIM >::activate(), madness::FunctionImpl< T, NDIM >::recursive_apply_op< opT, LDIM >::activate(), madness::Solver< T, NDIM >::apply_hf_exchange(), madness::FunctionImpl< T, NDIM >::add_op::forward_ctor(), madness::FunctionImpl< T, NDIM >::multiply_op< LDIM >::forward_ctor(), madness::FunctionImpl< T, NDIM >::recursive_apply_op< opT, LDIM >::forward_ctor(), data< T, NDIM >::initialize(), madness::load_coeffs(), main(), plotter1(), madness::read_twoscale(), test(), test_gconv(), test_in(), test_out(), test_partial_inner(), test_projector(), test_projector_outer(), test_Q12_projector(), test_XCOperator_matrix(), madness::two_scale_coefficients(), and madness::two_scale_hg().

g2()

double g2 ( const Vector< double, D > & r )

static

Referenced by madness::Solver< T, NDIM >::apply_hf_exchange(), data< T, NDIM >::initialize(), main(), madness::LowRankFunction< T, NDIM, LDIM >::orthonormalize(), plotter1(), plotter2(), test(), test_coulomb(), test_load_store(), test_partial_inner(), test_projector(), test_Q12_projector(), and test_size().

main()

int main	(	int	argc,
		char **	argv )

References a, b, e(), f, madness::f, madness::WorldGopInterface::fence(), madness::finalize(), g0(), g1(), g2(), madness::World::gop, madness::initialize(), ok(), madness::World::rank(), madness::FunctionDefaults< NDIM >::set_cubic_cell(), madness::FunctionDefaults< NDIM >::set_k(), madness::FunctionDefaults< NDIM >::set_thresh(), madness::World::size(), madness::startup(), state_max_err(), and statexy_max_err().

state_max_err()

double state_max_err ( const ResponseStateX< ClosedShell > & a, const ResponseStateX< ClosedShell > & b )

static

References a, b, and e().

Referenced by main().

statexy_max_err()

double statexy_max_err ( const ResponseStateXY< ClosedShell > & a, const ResponseStateXY< ClosedShell > & b )

static

References a, b, and e().

Referenced by main().

Variable Documentation

D

const std::size_t D = 3

static