mp2.ipp File Reference

#include <mpqc/chemistry/qc/lcao/mbpt/fwd.h>
#include <mpqc/chemistry/qc/lcao/mbpt/mp2.h>
#include "mpqc/chemistry/qc/lcao/integrals/direct_tile.h"
#include "mpqc/chemistry/qc/lcao/wfn/lcao_wfn.h"
#include "mpqc/util/misc/time.h"
#include <algorithm>
#include <memory>
#include <random>

Include dependency graph for mp2.ipp:

This graph shows which files directly or indirectly include this file:

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

Macros
#define	MPQC4_SRC_MPQC_CHEMISTRY_QC_MBPT_MP2_IPP_

Functions
template<typename Tile , typename Policy >
double	mpqc::lcao::detail::compute_mp2 (LCAOFactory< Tile, Policy > &lcao_factory, const std::shared_ptr< const Eigen::VectorXd > &orbital_energy, const std::shared_ptr< const ::mpqc::utility::TRange1Engine > &tr1_engine, bool df)
template<typename Tile , typename Policy >
double	mpqc::lcao::detail::compute_mp2_coarse_grained (LCAOFactory< Tile, Policy > &lcao_factory, const std::shared_ptr< const Eigen::VectorXd > &orbital_energy, const std::shared_ptr< const ::mpqc::utility::TRange1Engine > &tr1_engine, bool df)

Macro Definition Documentation

MPQC4_SRC_MPQC_CHEMISTRY_QC_MBPT_MP2_IPP_

#define MPQC4_SRC_MPQC_CHEMISTRY_QC_MBPT_MP2_IPP_