Singlet and triplet excited state electric dipole polarizabilities of conjugated hydrocarbons

dc.creatorTrsic, M.
dc.creatorSanhueza, J. E.
dc.creatorEspinoza, Ll
dc.date.accessioned2018-12-20T14:17:30Z
dc.date.available2018-12-20T14:17:30Z
dc.date.created2018-12-20T14:17:30Z
dc.date.issued1976
dc.identifierInternational Journal of Quantum Chemistry, Volumen 10, Issue 3, 2018, Pages 429-437
dc.identifier1097461X
dc.identifier00207608
dc.identifier10.1002/qua.560100306
dc.identifierhttp://repositorio.uchile.cl/handle/2250/155526
dc.description.abstractFirst excited singlet and triplet electric dipole polarizabilities are reported. The π polarizability is calculated by means of a modified Rayleigh–Schrödinger perturbation theory and an SCF‐LCAO basis. The σ contribution is included by an additive scheme. The polarization of the σ electrons is partially accounted for through an empirical correction. Results compare satisfactorily with a configuration interaction perturbation calculation. Copyright © 1976 John Wiley & Sons, Inc.
dc.languageen
dc.rightshttp://creativecommons.org/licenses/by-nc-nd/3.0/cl/
dc.rightsAttribution-NonCommercial-NoDerivs 3.0 Chile
dc.sourceInternational Journal of Quantum Chemistry
dc.subjectAtomic and Molecular Physics, and Optics
dc.subjectCondensed Matter Physics
dc.subjectPhysical and Theoretical Chemistry
dc.titleSinglet and triplet excited state electric dipole polarizabilities of conjugated hydrocarbons
dc.typeArtículos de revistas


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