test_integral.cpp File Reference

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

#include "mirp_bin/callback_helper.hpp"
#include "mirp_bin/testfile_io.hpp"
#include "mirp_bin/test_integral.hpp"
#include "mirp_bin/test_common.hpp"
#include <mirp/pragma.h>
#include <mirp/math.h>
#include <mirp/shell.h>
#include <cmath>
#include <iostream>
#include <fstream>

Include dependency graph for test_integral.cpp:

Namespaces
	mirp

Functions
static size_t	mirp::nintegrals (const integral_data_entry &ent)
	The number of integrals computed in an entry. More...
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<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<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 void	mirp::integral_create_test< 4 > (const std::string &, const std::string &, slong, long, const std::string &, callback_helper< 4 >::cb_str_type)
template long	mirp::integral_verify_test< 4 > (const std::string &, slong, callback_helper< 4 >::cb_str_type)
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.