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非晶Ti3Al合金的变形晶化机理的原子模拟
引用本文:王海龙,王秀喜,王 宇,梁海弋.非晶Ti3Al合金的变形晶化机理的原子模拟[J].物理学报,2007,56(3):1489-1493.
作者姓名:王海龙  王秀喜  王 宇  梁海弋
作者单位:中国科学技术大学中科院材料力学行为和设计重点实验室,合肥 230026
基金项目:国家自然科学基金(批准号:10502047)资助的课题.
摘    要:利用分子动力学方法研究了非晶Ti3Al合金拉伸过程中的晶化行为,模拟结果表明局部塑性变形导致非晶合金晶化.从微观结构演化的角度分析了拉伸过程中的晶化机理,局部剪切导致拉伸过程中晶粒发生成核与合并,最终生成的晶粒具有面心立方结构.晶核的生长过程伴随着应力强化现象,非晶相中的纳米晶粒能提高非晶合金材料的强度. 关键词: 非晶合金 变形晶化 分子动力学

关 键 词:非晶合金  变形晶化  分子动力学
文章编号:1000-3290/2007/56(03)/1489-05
收稿时间:2006-06-23
修稿时间:06 23 2006 12:00AM

Molecular dynamics simulation of deformation-induced crystallization mechanism in amorphous Ti3Al alloy
Wang Hai-Long,Wang Xiu-Xi,Wang Yu and Liang Hai-Yi.Molecular dynamics simulation of deformation-induced crystallization mechanism in amorphous Ti3Al alloy[J].Acta Physica Sinica,2007,56(3):1489-1493.
Authors:Wang Hai-Long  Wang Xiu-Xi  Wang Yu and Liang Hai-Yi
Institution:Key Laboratory of Mechanical Behavior and Design of Materials of Chinese Academy of Sciences, University of Science and Technology of China, Hefei 230026, China
Abstract:The crystallization of Ti3Al amorphous alloy during tensile deformation was studied with molecular dynamics. The simulation results show that the crystallization of amorphous alloy is induced by the local plastic deformation. The microstructure evolution was analyzed in the tension process. It is found that the nucleation and growth are induced by the shear localization and the final crystal phase has fcc structure. It is also found that the crystallization process is accompanied by strengthening of the material. The nanocrystal grains embedded in the amorphous phase can enhance the rigidity of the sample.
Keywords:amorphous alloy  deformation-induced crystallization  molecular dynamics
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