The divacancy formation energy for B2 FeAl Alloy simulated with Finnis-Sinclair Many-body Interatomic Potential

被引：0
|
作者：
Wang, Yue-hua [1 ]
Liu, Yan-xia
Wang, Xun [1 ]
机构：
[1] Shenyang Jianzhu Univ, Coll Sci, Shenyang 110168, Peoples R China
来源：
ADVANCES IN MATERIALS AND MATERIALS PROCESSING, PTS 1-3 | 2013年 / 652-654卷
关键词：
interatomic potential; FeAl alloy; divacancy; TRANSITION-METALS; DEFECTS;
D O I：
10.4028/www.scientific.net/AMR.652-654.1067
中图分类号：
T [工业技术];
学科分类号：
08 ;
摘要：
The Finnis-Sinclair many-body potential was fitted for binary FeAl alloy with B2 structure. As the examination to the acquired potential function, some properties were calculated, and the results agree with the experiments well. Further, properties of point defects, such as divacancies were studied as an application.
引用
收藏
页码：1067 / 1071
页数：5
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