Scine::Sparrow  5.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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Scine::Sparrow::TDDFTBSigmaVectorEvaluator< restrictedness > Member List

This is the complete list of members for Scine::Sparrow::TDDFTBSigmaVectorEvaluator< restrictedness >, including all inherited members.

evaluate(const Eigen::MatrixXd &guessVectors) const -> const Eigen::MatrixXd &finalScine::Sparrow::TDDFTBSigmaVectorEvaluator< restrictedness >
TDDFTBSigmaVectorEvaluator(std::shared_ptr< Eigen::MatrixXd > gammaMatrix, std::shared_ptr< Eigen::VectorXd > spinConstants, const OrderedInput< restrictedness > &orderedInput, Utils::SpinTransition spinBlock=Utils::SpinTransition::Singlet, TDDFTBType type=TDDFTBType::TDDFTB)Scine::Sparrow::TDDFTBSigmaVectorEvaluator< restrictedness >
~TDDFTBSigmaVectorEvaluator() final=default (defined in Scine::Sparrow::TDDFTBSigmaVectorEvaluator< restrictedness >)Scine::Sparrow::TDDFTBSigmaVectorEvaluator< restrictedness >