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Article
Gaussian Field Model of Dielectric Solvation Dynamics
The Journal of Physical Chemistry (1996)
  • Xueyu Song, California Institute of Technology
  • David Chandler, University of California
  • R. A. Marcus, California Institute of Technology
Abstract
Extending the Gaussian model of solvation (Chandler, D. Phys. ReV. E 1993, 48, 2898) to dynamics, we focus specifically on the problem of dielectric relaxation. In the Gaussian model, the solvent is described in terms of a linear responding field that is expelled from the volume occupied by the solute. The excluded volume affects the normal modes of the system, thereby playing a significant role in solvation dynamics. Even in the context of dielectric continuum theory, the excluded volume affects the polarization response outside that volume. We show that this effect can be analyzed generally and analytically.
Publication Date
July 18, 1996
DOI
10.1021/jp960887e
Publisher Statement
Reprinted (adapted) with permission from The Journal of Physical Chemistry, 100(29); 11954-11959. Doi: 10.1021/jp960887e. Copyright 1996 American Chemical Society.
Citation Information
Xueyu Song, David Chandler and R. A. Marcus. "Gaussian Field Model of Dielectric Solvation Dynamics" The Journal of Physical Chemistry Vol. 100 Iss. 29 (1996) p. 11954 - 11959
Available at: http://works.bepress.com/xueyu-song/4/