Kworker Class Reference

List of all members.

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

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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]

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Member Function Documentation

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

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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]

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

• source/scf/scf_utils.cc

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