Structural properties of methanol–water binary mixtures within the quantum cluster equilibrium model

Author:

Matisz G.12345,Kelterer A.-M.678910,Fabian W. M. F.11128910,Kunsági-Máté S.12345

Affiliation:

1. Department of General and Physical Chemistry

2. University of Pécs

3. 7624 Pécs

4. Hungary

5. János Szentágothai Research Center

6. Institute of Physical and Theoretical Chemistry

7. Graz University of Technology

8. NAWI Graz

9. 8010 Graz

10. Austria

11. Institute of Chemistry

12. University of Graz

Abstract

The Quantum Cluster Equilibrium (QCE) method computes cluster distributions and thermodynamic properties of binary methanol–water mixtures in agreement with experiments.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference92 articles.

1. Y. Marcus , Solvent Mixtures, Properties and Selective Solvation, CRC Press, 2002

2. A Critique of Some Recent Suggestions to Correct the Kirkwood−Buff Integrals

3. C. Reichardt , Solvents and Solvent Effects in Organic Chemistry, Wiley-VCH Verlag, Weinheim, 3rd edn, 2003

4. Molecular clustering inherent in the liquid state: Effect of relativity in intermolecular interaction energy

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