Vibrational corrections to static and dynamic hyperpolarizabilities of pure liquids: Calculations on methanol
- 1 September 1998
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 109 (9) , 3580-3588
- https://doi.org/10.1063/1.476954
Abstract
The methanol molecule is used as a test case for studying the simultaneous action of solvation and vibrational effects on static and dynamic hyperpolarizabilities within the reaction field model. The calculations indicate that the medium can play a significant role for the vibrational correction. The calculated third-order optical nonlinear susceptibilities of methanol in gas and liquid phases are in fair to good agreement with their experimental counterparts.Keywords
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