Modified embedded-atom method interatomic potential for the Fe-Pt alloy system

被引：38
作者：
Kim, J [1 ]
Koo, Y [1 ]
Lee, BJ [1 ]
机构：
[1] Pohang Univ Sci & Technol, Dept Mat Sci & Engn, Pohang 790784, South Korea
来源：
JOURNAL OF MATERIALS RESEARCH | 2006年 / 21卷 / 01期
关键词：
D O I：
10.1557/JMR.2006.0008
中图分类号：
T [工业技术];
学科分类号：
08 ;
摘要：
A semi-empirical interatomic potential formalism, the modified embedded atom method (MEAM), has been applied to obtain an interatomic potential for the Fe-Pt alloy system, based on the previously developed potentials for pure Fe and Pt. The potential can describe basic physical properties of the alloys (lattice parameter, bulk modulus, stability of individual phases, and order/disorder transformations), in good agreement with experimental information. The procedure for the determination of potential parameter values and comparisons between the present calculation and experimental data or high level calculation are presented. The applicability of the potential to atomistic studies to investigate structural evolution of Fe50Pt50 alloy thin films during post-annealing is also discussed.
引用
收藏
页码：199 / 208
页数：10
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