Connection between thermodynamic properties and diffusion coefficient for a system of non-interacting particles on a lattice with two non-equivalent sites

被引:15
作者
Chvoj, Z [1 ]
Conrad, H [1 ]
Chab, V [1 ]
机构
[1] MAX PLANCK GESELL, FRITZ HABER INST, D-14195 BERLIN, GERMANY
关键词
diffusion and migration; models of surface kinetics; non-equilibrium thermodynamics and statistical mechanics; surface diffusion;
D O I
10.1016/0039-6028(95)01312-1
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
By calculating the jump diffusion rate (T) and the thermodynamical factor (K-d) for a layer of non-interacting particles on a lattice with the non-equivalent bond sites we show that the diffusion coefficient D = Gamma K-d exhibits specific features as a function of coverage, such as steps or maxima at critical coverages, which correspond to phase transformations in the adlayer. The chemical potential of the adlayer is derived analytically from the free energy. The difference of binding energy between the two kinds of sites is described by a parameter k and it is shown that the chemical potential (or the thermodynamic factor) at the critical coverage indicates the existence of a diffuse phase transition which develops for k --> 0 into a first-order point phase transition.
引用
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页码:983 / 987
页数:5
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