| Literature DB >> 15268263 |
Abstract
This paper presents an exact solution for the free energy of linear solvation of a dipolar solute in an arbitrary dielectric material with a microscopic spectrum of polarization fluctuations. The solution is given in terms of wave vector-dependent longitudinal and transverse structure factors of the polarization fluctuations in the pure dielectric. Good agreement with computer simulations of dipole solvation in dipolar and dipolar--quadrupolar liquids is achieved.Entities:
Year: 2004 PMID: 15268263 DOI: 10.1063/1.1633545
Source DB: PubMed Journal: J Chem Phys ISSN: 0021-9606 Impact factor: 3.488