benchmark_exchange_commutator.cc File Reference

#include <madness.h>
#include <madness/chem/exchange_commutator.h>
#include <madness/chem/nemo.h>
#include <madness/chem/CCStructures.h>
#include <madness/chem/CCParameters.h>
#include <madness/chem/CCPotentials.h>
#include <madness/chem/lowrankfunction.h>
#include <madness/chem/ccpairfunction.h>
#include <madness/world/test_utilities.h>

Include dependency graph for benchmark_exchange_commutator.cc:

Functions
int	main (int argc, char **argv)

Function Documentation

main()

int main	(	int	argc,
		char **	argv )

References madness::ExchangeCommutator::ThreeRangeOptions::alpha_hi, madness::ExchangeCommutator::ThreeRangeOptions::alpha_lo, madness::ExchangeCommutator::SplitAlphaOptions::alpha_star, madness::ao, madness::apply(), madness::ExchangeCommutator::apply_KffK_6d(), madness::ExchangeCommutator::apply_KffK_lowrank_split_alpha(), madness::ExchangeCommutator::apply_KffK_lowrank_three_range(), madness::BSHOperator(), madness::ExchangeCommutator::compute_lrf_exchange_operator(), d, madness::ExchangeCommutator::diagnose_GKffK(), madness::ExchangeCommutator::diagnose_KffK(), e(), f, madness::finalize(), madness::CCFunction< T, NDIM >::function, madness::FunctionDefaults< NDIM >::cell, madness::FunctionDefaults< NDIM >::get_cell(), madness::FunctionDefaults< NDIM >::get_k(), madness::FunctionDefaults< NDIM >::get_thresh(), madness::HOLE, madness::initialize(), k, madness::commandlineparser::key_exists(), madness::ExchangeCommutator::ThreeRangeOptions::lrfparam_diffuse, madness::ExchangeCommutator::ThreeRangeOptions::lrfparam_medium, madness::ExchangeCommutator::ThreeRangeOptions::medium_use_6d, madness::ExchangeCommutator::ThreeRangeOptions::medium_use_taylor, madness::SeparatedConvolution< Q, NDIM >::modified(), madness::nemo, madness::orthonormalize_canonical(), madness::print(), madness::QCCalculationParametersBase::print(), madness::print_header2(), madness::DiagnosticMatrix< T, NDIM >::print_report(), madness::LowRankFunctionParameters::read_and_set_derived_values(), madness::Exchange< T, NDIM >::set_bra_and_ket(), madness::FunctionDefaults< NDIM >::set_cubic_cell(), madness::QCCalculationParametersBase::set_derived_value(), madness::FunctionDefaults< NDIM >::set_k(), madness::FunctionDefaults< NDIM >::set_tensor_type(), madness::FunctionDefaults< NDIM >::set_thresh(), madness::FunctionDefaults< NDIM >::set_truncate_mode(), madness::startup(), status, thresh, madness::TT_2D, v, and madness::commandlineparser::value().