Using kinetic Monte Carlo simulations to study phase separation in alloys

被引:26
作者
Weinkamer, R [1 ]
Fratzl, P
Gupta, HS
Penrose, O
Lebowitz, JL
机构
[1] Max Planck Inst Colloids & Interfaces, Dept Biomat, D-14424 Potsdam, Germany
[2] Heriot Watt Univ, Dept Math, Edinburgh EH14 4AS, Midlothian, Scotland
[3] Rutgers State Univ, Dept Math, New Brunswick, NJ 08903 USA
[4] Rutgers State Univ, Dept Phys, New Brunswick, NJ 08903 USA
关键词
phase separation; rafting; Monte Carlo simulation; kinetic Ising model; vacancy; elastic interactions;
D O I
10.1080/01411590410001672639
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
We review recent extensions of the kinetic Ising model used to investigate phase separation in binary alloys. Firstly. vacancies are included to model the diffusion of the atoms on the microscopic scale more realistically. These can change the coarsening rate and the coarsening mechanism. Secondly, the lattice is allowed to deform owing to the different sizes of the atoms and the resulting misfit between precipitates and matrix. The deformability of the lattice induces long-range elastic interactions between the atoms. These change the shape, orientation, and arrangement of the precipitates. The growth of the precipitates need not follow the R(t) proportional to t(1/3) law.
引用
收藏
页码:433 / 456
页数:24
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