ergo
Kworker Class Reference

Public Member Functions

 Kworker (symmMatrix &D_, const IntegralInfo &integralInfo_, const BasisInfoStruct &basisInfo_, const triangMatrix &invCholFactor_, bool doInvCholFactorTransformation_, const JK::ExchWeights &CAM_params_, const JK::Params &J_K_params_, std::vector< int > const &permutationHML_, std::vector< int > const &inversePermutationHML_)
void ComputeMatrix (ergo_real param, symmMatrix &result) const

Private Attributes

symmMatrixD
const IntegralInfointegralInfo
const BasisInfoStructbasisInfo
const triangMatrixinvCholFactor
bool doInvCholFactorTransformation
const JK::ExchWeightsCAM_params
JK::Params J_K_params
std::vector< int > const & permutationHML
std::vector< int > const & inversePermutationHML

Constructor & Destructor Documentation

Kworker::Kworker ( symmMatrix D_,
const IntegralInfo integralInfo_,
const BasisInfoStruct basisInfo_,
const triangMatrix invCholFactor_,
bool  doInvCholFactorTransformation_,
const JK::ExchWeights CAM_params_,
const JK::Params J_K_params_,
std::vector< int > const &  permutationHML_,
std::vector< int > const &  inversePermutationHML_ 
)
inline

References J_K_params.

Member Function Documentation

Member Data Documentation

const BasisInfoStruct& Kworker::basisInfo
private

Referenced by ComputeMatrix().

const JK::ExchWeights& Kworker::CAM_params
private

Referenced by ComputeMatrix().

symmMatrix& Kworker::D
private

Referenced by ComputeMatrix().

bool Kworker::doInvCholFactorTransformation
private

Referenced by ComputeMatrix().

const IntegralInfo& Kworker::integralInfo
private

Referenced by ComputeMatrix().

const triangMatrix& Kworker::invCholFactor
private

Referenced by ComputeMatrix().

std::vector<int> const& Kworker::inversePermutationHML
private

Referenced by ComputeMatrix().

JK::Params Kworker::J_K_params
private

Referenced by ComputeMatrix(), and Kworker().

std::vector<int> const& Kworker::permutationHML
private

Referenced by ComputeMatrix().


The documentation for this class was generated from the following file: