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const Eigen::VectorXd | getAdsorptionCoefficients () const |
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void | setSquaredNormalDipoleGradient (const Eigen::VectorXd &newSquaredNormalDipoleGradient) |
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Eigen::VectorXd | calculateRelativeVibrationalIntensities () |
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static Eigen::VectorXd | transformCartesianToSquaredNormalDipoleGradient (const Eigen::MatrixXd &massWeightedEigenvectors, const Eigen::MatrixX3d &cartesianDipoleMoment, const std::vector< double > &masses) |
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The documentation for this class was generated from the following files: