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Scine::Sparrow
4.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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#include "TDDFTBSigmaVectorEvaluator.h"#include <Sparrow/Implementations/Dftb/TimeDependent/LinearResponse/BasisPruner.h>#include <Sparrow/Implementations/Exceptions.h>#include <Utils/Scf/LcaoUtils/ElectronicOccupation.h>#include <iostream>
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| void | Scine::Sparrow::detail::negativeBetaTransitions (Eigen::Ref< Eigen::VectorXd > toTransform, const Eigen::Ref< const Eigen::Matrix< bool,-1, 1 >> &isBeta) |