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Rayleigh Depolarization Ratios, Kerr Effects, Polarizabilities, and Hyperpolarizabilities of CH₃Br, CH₂Br₂, CHBr₃ and CBr₄.: Comparison of Experimental and ab Initio Calculated Polarizabilities |
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American Chemical Society |
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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. |
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The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 106(16), p. 4257-4262 |
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