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Cubic optical response of molecules in a nonequilibrium and equilibrium solvation model
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1999 (English)In: Journal of Physical Chemistry A, ISSN 1089-5639, E-ISSN 1520-5215, Vol. 103, no 42, p. 8375-8383Article in journal (Refereed) Published
Abstract [en]

The cubic response equations governing nonequilibrium and equilibrium solvation in the continuum approach are derived and implemented. We consider solvent effects on the frequency dependent second hyperpolarizability. We illustrate the effects of optical and static dielectric constants through sample calculations on H2O and H2CO.

Place, publisher, year, edition, pages
1999. Vol. 103, no 42, p. 8375-8383
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Theoretical Chemistry
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URN: urn:nbn:se:kth:diva-198820Scopus ID: 2-s2.0-0001614707OAI: oai:DiVA.org:kth-198820DiVA, id: diva2:1058913
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QC 20161222

Available from: 2016-12-21 Created: 2016-12-21 Last updated: 2017-11-29Bibliographically approved

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Sylvester-Hvid, K. O.
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