Global2c2eMatrix.cpp File Reference

#include "Global2c2eMatrix.h"
#include <Utils/Constants.h>
#include <iostream>

Include dependency graph for Global2c2eMatrix.cpp:

Functions
template<>
Value3DType < Utils::DerivativeOrder::Zero >	Scine::Sparrow::nddo::multipole::Global2c2eMatrix::evaluateMatrixElement< Utils::DerivativeOrder::Zero > (orbPair_index_t op1, orbPair_index_t op2)
template<>
Value3DType < Utils::DerivativeOrder::One >	Scine::Sparrow::nddo::multipole::Global2c2eMatrix::evaluateMatrixElement< Utils::DerivativeOrder::One > (orbPair_index_t op1, orbPair_index_t op2)
template<>
Value3DType < Utils::DerivativeOrder::Two >	Scine::Sparrow::nddo::multipole::Global2c2eMatrix::evaluateMatrixElement< Utils::DerivativeOrder::Two > (orbPair_index_t op1, orbPair_index_t op2)
template<>
void	Scine::Sparrow::nddo::multipole::Global2c2eMatrix::evaluate< Utils::DerivativeOrder::Zero > ()
template<>
void	Scine::Sparrow::nddo::multipole::Global2c2eMatrix::evaluate< Utils::DerivativeOrder::One > ()
template<>
void	Scine::Sparrow::nddo::multipole::Global2c2eMatrix::evaluate< Utils::DerivativeOrder::Two > ()
template<>
void	Scine::Sparrow::nddo::multipole::Global2c2eMatrix::calculate< Utils::DerivativeOrder::Zero > (const Eigen::Vector3d &Rab)
template<>
void	Scine::Sparrow::nddo::multipole::Global2c2eMatrix::calculate< Utils::DerivativeOrder::One > (const Eigen::Vector3d &Rab)
template<>
void	Scine::Sparrow::nddo::multipole::Global2c2eMatrix::calculate< Utils::DerivativeOrder::Two > (const Eigen::Vector3d &Rab)

Detailed Description

Copyright

This code is licensed under the 3-clause BSD license.
Copyright ETH Zurich, Department of Chemistry and Applied Biosciences, Reiher Group.
See LICENSE.txt for details.