On the Kirkwood-Buff inversion procedure
Abstract
A general approach is presented to express the Kirkwood-Buff integrals, the central component of the Kirkwood-Buff theory of solutions, in terms of thermodynamic properties of solution mixtures. A general expression valid for any number of components is provided in terms of matrix cofactors, while explicit expressions are given for three and four component mixtures. The corresponding symmetric ideal solution values are also presented for four and higher component mixtures.
- Publication:
-
Journal of Chemical Physics
- Pub Date:
- September 2008
- DOI:
- Bibcode:
- 2008JChPh.129l4509S
- Keywords:
-
- 61.20.Gy;
- 65.20.-w;
- 62.10.+s;
- Theory and models of liquid structure;
- Thermal properties of liquids;
- Mechanical properties of liquids