Dipole solvation in dielectrics

Research output: Contribution to journalArticle

37 Scopus citations

Abstract

An exact, analytical solution for the linear solvation free energy of a dipolar solute in an arbitrary dielectric material characterized by the microscopic spectrum of fluctuations of its dipolar polarization is formulated. A general formulation of the problem in terms of a solute of an arbitrary shape with an arbitrary charge distribution. Thus, this formulation may provide a basis for numerical calculations of the solvation thermodynamics.

Original languageEnglish (US)
Pages (from-to)1375-1382
Number of pages8
JournalJournal of Chemical Physics
Volume120
Issue number3
DOIs
StatePublished - Jan 15 2004

ASJC Scopus subject areas

  • Physics and Astronomy(all)
  • Physical and Theoretical Chemistry

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