DOI

We propose a modified Monte-Carlo method for studying the solvation of ions in a mixed solvent. We include two-particle shifts in the algorithm along with oneparticle shifts. Some of the two-particle shifts end with exchange of adjacent molecules. We have carried out calculations for the system Na+-N1·H2O-N2·MeOH for N1=N2=6 and N1=N2=9. We have concluded that there is preferential hydration of the Na+ ion in an equimolar water-methanol mixture.

Original languageEnglish
Pages (from-to)213-216
Number of pages4
JournalTheoretical and Experimental Chemistry
Volume24
Issue number2
DOIs
StatePublished - 1 Mar 1988

    Scopus subject areas

  • Chemistry(all)

ID: 43151813