Chemical diffusion in an interacting lattice gas: Analytic theory and simple applications

被引:23
作者
Gortel, ZW [1 ]
Zaluska-Kotur, MA
机构
[1] Univ Alberta, Dept Phys, Edmonton, AB T6G 2J1, Canada
[2] Polish Acad Sci, Inst Phys, PL-02668 Warsaw, Poland
基金
加拿大自然科学与工程研究理事会;
关键词
D O I
10.1103/PhysRevB.70.125431
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
A variational approach to microscopic kinetics of an interacting lattice gas is presented. It accounts for the equilibrium correlations in the system and allows one to derive an algebraic expression for the particle density (coverage) dependent chemical diffusion coefficient for a wide variety of interaction models. Detailed derivation is presented for a one dimensional case for which the results are compared with the results of Monte Carlo simulations. Generalization and an application to the simplest case of the two dimensional lattice gas is briefly described.
引用
收藏
页码:125431 / 1
页数:25
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