基于原子模拟的金属Fe晶界能与晶界取向相关性分析
Analysis of the Correlation Between the Energy and Crystallographic Orientation of Grain Boundaries in Fe Based on Atomistic Simulations
基于原子模拟的金属Fe晶界能与晶界取向相关性分析 |
| 黄曾鑫, 蒋逸航, 赖春明, 吴庆捷, 刘大海, 杨亮 |
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Analysis of the Correlation Between the Energy and Crystallographic Orientation of Grain Boundaries in Fe Based on Atomistic Simulations |
| HUANG Zengxin, JIANG Yihang, LAI Chunming, WU Qingjie, LIU Dahai, YANG Liang |
| 图1 球状双晶模型构建特定取向差(Δ g )和特定晶界面取向( n )晶界示意图 |
| Fig.1 Illustration for constructing a spherical cell containing a grain boundary (GB) with misorientation (Δ g ) and orientation of GB plane ( n ) ( g0—orientation of initial monocrystal, gA —orientation for grain A,gB —orientation for grain B) |
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