On the evaluation of the Kirkwood-Buff integrals of aqueous acetone mixtures

A. Perera, F. Sokolić, L. Almásy, P. Westh, Y. Koga

Research output: Contribution to journalArticle

31 Citations (Scopus)


The Kirkwood-Buff integrals of acetone-water mixtures are determined using two experimental techniques: small-angle neutron scattering and vapor pressure measurements, in order to test the precision and reliability that can be achieved. The data are then compared with those previously reported by different authors, which tend to show considerable variation between them. The various possible sources of inaccuracies are pointed out, both from experimental origins and from the numerical treatment of the data. Comparison with recent simulation results allows to critically compare different models and provide some information about the microstructure of the aqueous mixture.

Original languageEnglish
Article number024503
JournalJournal of Chemical Physics
Issue number2
Publication statusPublished - Aug 18 2005

ASJC Scopus subject areas

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

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