task_integral_kernels.cpp File Reference

#include "mpqc/chemistry/qc/lcao/integrals/task_integral_kernels.h"
#include "mpqc/math/groups/petite_list.h"
#include <TiledArray/tensor/tensor_map.h>
#include <libint2/engine.impl.h>

Include dependency graph for task_integral_kernels.cpp:

Namespaces
	mpqc
	The top-level namespace for all Massively Parallel Quantum Chemistry package.
	mpqc::lcao
	mpqc::lcao::gaussian
	mpqc::lcao::gaussian::detail

Functions
template __libint2_engine_inline libint2::any	libint2::Engine::enforce_params_type< libint2::detail::default_operator_traits::oper_params_type > (libint2::Operator oper, const libint2::detail::default_operator_traits::oper_params_type &params, bool throw_if_wrong_type)
const std::vector< Engine::compute2_ptr_type > &	mpqc::lcao::gaussian::detail::libint2_compute2_ptrs (const Engine &engine)
void	mpqc::lcao::gaussian::detail::compute_screening_statistics (bool onoff)
bool	mpqc::lcao::gaussian::detail::compute_screening_statistics ()

Variables
double	mpqc::lcao::gaussian::detail::integral_engine_precision = 0.0
std::shared_ptr< IntegralProfile >	mpqc::lcao::gaussian::detail::total_ints_profile
	profile of all integrals for which compute was considered before screening More...
std::shared_ptr< IntegralProfile >	mpqc::lcao::gaussian::detail::computed_ints_profile
	profile of all integrals for which compute was invoked More...
std::shared_ptr< IntegralProfile >	mpqc::lcao::gaussian::detail::nonzero_ints_profile
	profile of all integrals for which compute returned nonzero More...
std::shared_ptr< IntegralProfile >	mpqc::lcao::gaussian::detail::underscreened_ints_profile
	profile of integrals below the screening threshold that were evaluated More...

Function Documentation

libint2::Engine::enforce_params_type< libint2::detail::default_operator_traits::oper_params_type >()

template __libint2_engine_inline libint2::any libint2::Engine::enforce_params_type< libint2::detail::default_operator_traits::oper_params_type >	(	libint2::Operator	oper,
		const libint2::detail::default_operator_traits::oper_params_type &	params,
		bool	throw_if_wrong_type
	)