plotao.cc File Reference

#include <madness/mra/mra.h>
#include <iostream>
#include <vector>
#include <iomanip>
#include <algorithm>
#include <cstring>
#include <cstdlib>
#include <cmath>

Include dependency graph for plotao.cc:

Classes
class	LevelPmap

Typedefs
typedef std::shared_ptr < WorldDCPmapInterface< Key< 3 > > >	pmapT
typedef Vector< double, 3 >	coordT
typedef std::shared_ptr < FunctionFunctorInterface < double, 3 > >	functorT
typedef Function< double, 3 >	functionT
typedef std::vector< functionT >	vecfuncT
typedef Tensor< double >	tensorT
typedef FunctionFactory < double, 3 >	factoryT

Functions
tensorT	Q3 (const tensorT &s)
	Given overlap matrix, return rotation with 3rd order error to orthonormalize the vectors. More...
void	set_protocol (World &world, double thresh)
int	main (int argc, char *argv[])

Typedef Documentation

typedef Vector<double,3> coordT

typedef FunctionFactory<double,3> factoryT

typedef Function<double,3> functionT

typedef std::shared_ptr< FunctionFunctorInterface<double,3> > functorT

typedef std::shared_ptr< WorldDCPmapInterface< Key<3> > > pmapT

typedef Tensor<double> tensorT

typedef std::vector<functionT> vecfuncT

Function Documentation

int main	(	int	argc,
		char *	argv[]
	)

References SafeMPI::COMM_WORLD, madness::error(), madness::WorldGopInterface::fence(), madness::finalize(), madness::World::gop, madness::initialize(), madness::print(), madness::print_stats(), madness::World::rank(), madness::FunctionDefaults< NDIM >::set_pmap(), set_protocol(), and madness::startup().

tensorT Q3

(

const tensorT &

s

)

Given overlap matrix, return rotation with 3rd order error to orthonormalize the vectors.

References madness::inner().

void set_protocol	(	World &	world,
		double	thresh
	)

References madness::print(), madness::World::rank(), madness::FunctionDefaults< NDIM >::set_apply_randomize(), madness::FunctionDefaults< NDIM >::set_autorefine(), madness::FunctionDefaults< NDIM >::set_cubic_cell(), madness::FunctionDefaults< NDIM >::set_initial_level(), madness::FunctionDefaults< NDIM >::set_k(), madness::FunctionDefaults< NDIM >::set_project_randomize(), madness::FunctionDefaults< NDIM >::set_refine(), madness::FunctionDefaults< NDIM >::set_thresh(), and madness::FunctionDefaults< NDIM >::set_truncate_mode().

Referenced by main().