A steady-state approach to determine diffusion coefficients: The migration of silicon on the Si(100) surface

被引:15
作者
Aldao, CM [1 ]
Iguain, JL [1 ]
Martin, HO [1 ]
机构
[1] NATL UNIV LA PLATA,DEPT PHYS,SCH EXACT & NAT SCI,RA-7600 MAR DEL PLATA,BUENOS AIRES,ARGENTINA
关键词
atomistic dynamics; silicon; surface diffusion;
D O I
10.1016/0039-6028(96)00828-X
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
We introduce a steady-state method to analytically determine diffusion coefficients for a particle in a strip with multiple inequivalent adsorption sites in the unit cell. This approach is applied to a variety of models showing its simplicity and usefulness. In particular, the diffusion coefficient of a Si adatom on the Si(100) for a model based on the Stillinger-Weber potential is computed. Comparisons with stochastic kinetic simulations are presented.
引用
收藏
页码:483 / 490
页数:8
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