English

Chemical-Potential Route: A Hidden Percus-Yevick Equation of State for Hard Spheres

Statistical Mechanics 2012-09-24 v2 Soft Condensed Matter Chemical Physics

Abstract

The chemical potential of a hard-sphere fluid can be expressed in terms of the contact value of the radial distribution function of a solute particle with a diameter varying from zero to that of the solvent particles. Exploiting the explicit knowledge of such a contact value within the Percus--Yevick (PY) theory, and using standard thermodynamic relations, a hitherto unknown PY equation of state, p/ρkBT=(9/η)ln(1η)(1631η)/2(1η)2p/\rho k_BT=-(9/\eta)\ln(1-\eta)-(16-31\eta)/2(1-\eta)^2, is unveiled. This equation of state turns out to be better than the one obtained from the conventional virial route. Interpolations between the chemical-potential and compressibility routes are shown to be more accurate than the widely used Carnahan--Starling equation of state. The extension to polydisperse hard-sphere systems is also presented.

Keywords

Cite

@article{arxiv.1204.4551,
  title  = {Chemical-Potential Route: A Hidden Percus-Yevick Equation of State for Hard Spheres},
  author = {Andrés Santos},
  journal= {arXiv preprint arXiv:1204.4551},
  year   = {2012}
}

Comments

5 pages, 1 figure; v2: extension to mixtures; new version of figure