test_IntegratorXX.cc File Reference

#include <madness.h>
#include <madness/world/test_utilities.h>
#include <madness/chem/IntegratorXX.h>

Include dependency graph for test_IntegratorXX.cc:

Classes
struct	spherical_harmonic

Functions
double	dx2y2_func (const Vector< double, 3 > &r)
double	dxy_func (const Vector< double, 3 > &r)
double	dxz_func (const Vector< double, 3 > &r)
double	dyz_func (const Vector< double, 3 > &r)
double	dz2_func (const Vector< double, 3 > &r)
int	main (int argc, char **argv)
double	px_func (const Vector< double, 3 > &r)
double	py_func (const Vector< double, 3 > &r)
double	pz_func (const Vector< double, 3 > &r)
double	s_func (const Vector< double, 3 > &r)
int	test_construction ()
int	test_integration (World &world)

Function Documentation

dx2y2_func()

double dx2y2_func

(

const Vector< double, 3 > &

r

)

References madness::inner().

Referenced by spherical_harmonic::spherical_harmonic().

dxy_func()

double dxy_func

(

const Vector< double, 3 > &

r

)

References madness::inner().

Referenced by spherical_harmonic::spherical_harmonic().

dxz_func()

double dxz_func

(

const Vector< double, 3 > &

r

)

References madness::inner().

Referenced by spherical_harmonic::spherical_harmonic().

dyz_func()

double dyz_func

(

const Vector< double, 3 > &

r

)

References madness::inner().

Referenced by spherical_harmonic::spherical_harmonic().

dz2_func()

double dz2_func

(

const Vector< double, 3 > &

r

)

References madness::inner().

Referenced by spherical_harmonic::spherical_harmonic().

main()

int main	(	int	argc,
		char **	argv
	)

References madness::WorldGopInterface::fence(), madness::finalize(), madness::World::gop, madness::initialize(), madness::FunctionDefaults< NDIM >::set_cubic_cell(), madness::FunctionDefaults< NDIM >::set_k(), madness::FunctionDefaults< NDIM >::set_thresh(), madness::startup(), test_construction(), and test_integration().

px_func()

double px_func

(

const Vector< double, 3 > &

r

)

References madness::inner().

Referenced by spherical_harmonic::spherical_harmonic().

py_func()

double py_func

(

const Vector< double, 3 > &

r

)

References madness::inner().

Referenced by spherical_harmonic::spherical_harmonic().

pz_func()

double pz_func

(

const Vector< double, 3 > &

r

)

References madness::inner().

Referenced by spherical_harmonic::spherical_harmonic().

s_func()

double s_func

(

const Vector< double, 3 > &

r

)

References madness::inner().

Referenced by spherical_harmonic::spherical_harmonic().

test_construction()

int test_construction

(

)

References madness::test_output::end(), GridBuilder::get_points(), GridBuilder::make_grid(), and madness::points.

Referenced by main().

test_integration()

int test_integration

(

World &

world

)

References std::abs(), madness::test_output::checkpoint(), madness::test_output::end(), madness::error(), exact, madness::f, GridBuilder::get_angular_order(), GridBuilder::get_nradial(), GridBuilder::get_points(), GridBuilder::get_weights(), madness::inner(), m, GridBuilder::make_grid(), madness::Function< T, NDIM >::norm2(), madness::points, madness::print(), madness::r2(), GridBuilder::set_angular_order(), GridBuilder::set_nradial(), GridBuilder::set_origin(), madness::BaseTensor::size(), and madness::weights.

Referenced by main().