test_integral.hpp File Reference

Functions related to testing four-center integrals. More...

#include <mirp/typedefs.h>
#include <string>
#include "mirp_bin/callback_helper.hpp"

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Namespaces
	mirp

Functions
template<int N>
void	mirp::integral_single_create_test (const std::string &input_filepath, const std::string &output_filepath, slong working_prec, long ndigits, const std::string &header, typename callback_helper< N >::cb_single_str_type cb)
	Creates a test of single cartesian integrals. More...
template void	mirp::integral_single_create_test< 4 > (const std::string &, const std::string &, slong, long, const std::string &, callback_helper< 4 >::cb_single_str_type)
template<int N>
long	mirp::integral_single_verify_test (const std::string &filepath, slong working_prec, typename callback_helper< N >::cb_single_str_type cb)
	Runs a test of single cartesian integrals using interval math. More...
template long	mirp::integral_single_verify_test< 4 > (const std::string &, slong, callback_helper< 4 >::cb_single_str_type)
template<int N>
long	mirp::integral_single_verify_test_exact (const std::string &filepath, typename callback_helper< N >::cb_single_exact_type cb, typename callback_helper< N >::cb_single_type cb_arb)
	Test single cartesian integrals in exact double precision. More...
template long	mirp::integral_single_verify_test_exact< 4 > (const std::string &, callback_helper< 4 >::cb_single_exact_type, callback_helper< 4 >::cb_single_type)
template<int N>
void	mirp::integral_create_test (const std::string &input_filepath, const std::string &output_filepath, slong working_prec, long ndigits, const std::string &header, typename callback_helper< N >::cb_str_type cb)
	Creates a test of contracted integrals. More...
template void	mirp::integral_create_test< 4 > (const std::string &, const std::string &, slong, long, const std::string &, callback_helper< 4 >::cb_str_type)
template<int N>
long	mirp::integral_verify_test (const std::string &filepath, slong working_prec, typename callback_helper< N >::cb_str_type cb)
	Runs a test of single cartesian integrals. More...
template long	mirp::integral_verify_test< 4 > (const std::string &, slong, callback_helper< 4 >::cb_str_type)
template<int N>
long	mirp::integral_verify_test_exact (const std::string &filepath, typename callback_helper< N >::cb_exact_type cb, typename callback_helper< N >::cb_type cb_arb)
	Test contracted integrals in exact double precision. More...
template long	mirp::integral_verify_test_exact< 4 > (const std::string &, callback_helper< 4 >::cb_exact_type, callback_helper< 4 >::cb_type)

Detailed Description

Functions related to testing four-center integrals.