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Theoretical investigation of the static (dynamic) polarizability and second hyperpolarizability of DAAD quadrupolar push–pull molecules. A comparison among HF (TD-HF), DFT (TD-B3LYP), and MP2 (TD-MP2) methods

Molecular SpectroscopyEngineeringTheoretical InvestigationNatural SciencesMolecular MaterialPhysical ChemistrySecond HyperpolarizabilityComputational ChemistryQuantum ChemistryChemistryMolecule-based MaterialBiophysics