Thermodynamics of the one-dimensional parallel Kawasaki model: exact solution and mean-field approximations

Phys Rev E Stat Nonlin Soft Matter Phys. 2014 Aug;90(2):022118. doi: 10.1103/PhysRevE.90.022118. Epub 2014 Aug 15.

Abstract

The adsorption isotherm for the recently proposed parallel Kawasaki (PK) lattice-gas model [Phys. Rev. E 88, 062144 (2013)] is calculated exactly in one dimension. To do so, a third-order difference equation for the grand-canonical partition function is derived and solved analytically. In the present version of the PK model, the attraction and repulsion effects between two neighboring particles and between a particle and a neighboring empty site are ruled, respectively, by the dimensionless parameters ϕ and θ. We discuss the inflections induced in the isotherms by situations of high repulsion, the role played by finite lattice sizes in the emergence of substeps, and the adequacy of the two most widely used mean-field approximations in lattice gases, namely, the Bragg-Williams and the Bethe-Peierls approximations.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Adsorption
  • Gases
  • Models, Theoretical*
  • Thermodynamics*

Substances

  • Gases