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Optical and nonlinear optical properties of Ln(Tp)<sub>2</sub>, where Ln = La,…,Lu and Tp = tris(pyrazolyl)borate: a DFT+TD-DFT study
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Citations
94
References
2019
Year
Optical MaterialsEngineeringNonlinear OpticsComputational ChemistryChemistryOptical CharacterizationSpectroscopic PropertySpectra-structure CorrelationOptical PropertiesOptical SystemsOptical SpectroscopyDynamic PolarizabilityMagnetic MomentPhotophysical PropertyPhotonicsInorganic ChemistryPhysicsNon-linear OpticDft CalculationsQuantum ChemistryNonlinear Optical PropertiesNatural SciencesSpectroscopyDft+td-dft StudyApplied PhysicsOptical PhysicCoordination ComplexMolecular Complex
DFT calculations of electronic, structural, thermodynamic properties, magnetic moment, static and dynamic polarizability and hyperpolarizability of Ln(Tp)<sub>2</sub> (Ln = rare earths, Tp = ring-unsubstituted tris(pyrazolyl)borate) complexes.
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