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Public Member Functions | Private Attributes | List of all members
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

symmMatrix & D
 
const IntegralInfo & integralInfo
 
const BasisInfoStruct & basisInfo
 
const triangMatrix & invCholFactor
 
bool doInvCholFactorTransformation
 
const JK::ExchWeights & CAM_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 Jworker::ComputeMatrix(), and Jworker::J_K_params.

Member Function Documentation

void Kworker::ComputeMatrix ( ergo_real  param,
symmMatrix &  result 
) const

References Jworker::basisInfo, compute_K_by_boxes_sparse(), Jworker::D, Jworker::doInvCholFactorTransformation, Jworker::integralInfo, Jworker::invCholFactor, Jworker::J_K_params, Jworker::permutationHML, JK::Params::threshold_K, and mat::transpose().

Member Data Documentation

const BasisInfoStruct& Kworker::basisInfo
private
const JK::ExchWeights& Kworker::CAM_params
private
symmMatrix& Kworker::D
private
bool Kworker::doInvCholFactorTransformation
private
const IntegralInfo& Kworker::integralInfo
private
const triangMatrix& Kworker::invCholFactor
private
std::vector<int> const& Kworker::inversePermutationHML
private
JK::Params Kworker::J_K_params
private
std::vector<int> const& Kworker::permutationHML
private
The documentation for this class was generated from the following file: