The relative surface energy of hexagonal close-packed crystals

被引:49
|
作者
Matysina, ZA [1 ]
机构
[1] Dnepropetrovsk Natl Univ, UA-320000 Dnepropetrovsk, Ukraine
关键词
surface energy; hexagonal close-packed crystal; broken-bond model;
D O I
10.1016/S0254-0584(99)00050-4
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Surface energies of hexagonal close-packed (hcp) crystals for three families of lattice site planes have been computed and their angular correlations have been determined. The broken bond method and the model of stepped microprojections of crystal faces were employed. The atomic interactions were taken into account in two coordinate spheres. Relative surface energies have been computed for Be, Cd, Co, Hf,Mg, Ti, Zn, Zr. The theoretical results are compared with experimental data. (C) 1999 Published by Elsevier Science S.A. All rights reserved.
引用
收藏
页码:70 / 78
页数:9
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