Embedded-atom potential for oxygen

被引:0
|
作者
Ouyang, YF [1 ]
Cheng, HM
Jin, ZP
机构
[1] Guangxi Univ, Dept Phys, Nanning 530004, Peoples R China
[2] Cent S Univ, Dept Mat Sci & Engn, Changsha 410083, Peoples R China
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D O I
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中图分类号
T [工业技术];
学科分类号
08 ;
摘要
The analytic embedded-atom potential for oxygen is developed from the experimental data and the results of the first-principle. The potential is used to predict the geometries and energies of O(3), fcc, bcc, sc and diamond. The predictions are in good agreement with experimental data available and other theoretical results.
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页码:460 / 462
页数:3
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