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Title: Rayleigh Depolarization Ratios, Kerr Effects, Polarizabilities, and Hyperpolarizabilities of CH₃Br, CH₂Br₂, CHBr₃ and CBr₄.: Comparison of Experimental and ab Initio Calculated Polarizabilities
Contributor(s): Blanch, Ewan (author); Keir, Roland (author); Ritchie, Geoffrey (author)
Publication Date: 2002
DOI: 10.1021/jp020003t
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Abstract: Improved equipment has been used to record the vapor-phase Rayleigh depolarization ratios and electrooptical Kerr effects of CH₃Br, CH₂Br₂, CHBr₃, and CBr₄ at elevated temperatures. The measurements yield experimental values of the anisotropic polarizabilities and the Kerr hyperpolarizabilities of these molecules. As well, Dougherty and Spackman's HUZ-SV(+sd+sp) basis set has been used to compute SCF and MP2-level polarizabilities, and these are compared with the experimental results.
Publication Type: Journal Article
Source of Publication: The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 106(16), p. 4257-4262
Publisher: American Chemical Society
Place of Publication: Washington, DC
ISSN: 1520-5215
Field of Research (FOR): 020201 Atomic and Molecular Physics
Peer Reviewed: Yes
HERDC Category Description: C1 Refereed Article in a Scholarly Journal
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