Electric Field Simulation of Substituents in Donor−Acceptor Polyenes: A Comparison with Ab Initio Predictions for Dipole Moments, Polarizabilities, and Hyperpolarizabilities-Reference-Cited by-同舟云学术

Electric Field Simulation of Substituents in Donor−Acceptor Polyenes: A Comparison with Ab Initio Predictions for Dipole Moments, Polarizabilities, and Hyperpolarizabilities

Published:2000-08-08 Issue:33 Volume:122 Page:8007-8012
ISSN:0002-7863
Container-title:Journal of the American Chemical Society
language:en
Short-container-title:J. Am. Chem. Soc.

Author:

Kirtman Bernard¹,Champagne Benoît¹,Bishop David M.¹

Affiliation:

1. Contribution from the Department of Chemistry, University of California, Santa Barbara, California 93106, Laboratoire de Chimie Théorique Appliquée, Facultés Universitaires Notre-Dame de la Paix, rue de Bruxelles, 61, B-5000 Namur, Belgium, and Department of Chemistry, University of Ottawa, Ottawa, Canada K1N 6N5

Publisher

American Chemical Society (ACS)

Subject

Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis

Link

https://pubs.acs.org/doi/pdf/10.1021/ja993226e

Reference33 articles.

1. A Unified Description of Linear and Nonlinear Polarization in Organic Polymethine Dyes

2. Tuning of large second hyperpolarizabilities in organic conjugated compounds

3. Electric Field Modulated Nonlinear Optical Properties of Donor-Acceptor Polyenes: Sum-Over-States Investigation of the Relationship between Molecular Polarizabilities (.alpha., .beta., and .gamma.) and Bond Length Alternation

4. Analysis of the Large Hyperpolarizabilities of Push-Pull Quinonoid Molecules

5. Reduced electronic density matrices, effective Hamiltonians, and nonlinear susceptibilities of conjugated polyenes

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