The first hyperpolarizability of nitrobenzene in benzene solutions: investigation of the effects of electron correlation within the sequential QM/MM approach
Author:
Affiliation:
1. Laboratoire de Chimie Théorique
2. Unité de Chimie Physique Théorique et Structurale
3. University of Namur
4. B-5000 Namur
5. Belgium
Abstract
Molecular polarization due to solvation amplifies the impact of electron correlation on the first hyperpolarizability of nitrobenzene.
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2015/CP/C5CP03455H
Reference97 articles.
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2. M. G. Papadopulos , A. J.Sadlej and J.Leszcczynski, Non-linear Optical Properties of Matter – From Molecules to Condensed Phases, Springer, Dordrecht, 2006
3. Design and Characterization of Molecular Nonlinear Optical Switches
4. Thirty years of continuum solvation chemistry: a review, and prospects for the near future
5. Quantum Mechanical Continuum Solvation Models
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