| 晶体相场法模拟小角度晶界的位错结构及其演化 |
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| 引用本文： | 卢成健,蒋丽婷,王玉玲,罗志荣,黄创高,高英俊. 晶体相场法模拟小角度晶界的位错结构及其演化[J]. 广西科学, 2013, 20(4): 316-320 |
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| 作者姓名： | 卢成健 蒋丽婷 王玉玲 罗志荣 黄创高 高英俊 |
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| 作者单位： | 广西大学物理科学与工程技术学院, 广西南宁 530004;玉林师范学院物理科学与工程技术学院, 广西玉林 537000,广西大学物理科学与工程技术学院, 广西南宁 530004,广西大学物理科学与工程技术学院, 广西南宁 530004,广西大学物理科学与工程技术学院, 广西南宁 530004;玉林师范学院物理科学与工程技术学院, 广西玉林 537000,广西大学物理科学与工程技术学院, 广西南宁 530004;广西大学广西有色金属及特色材料加工重点实验室, 广西南宁 530004,广西大学物理科学与工程技术学院, 广西南宁 530004;广西大学广西有色金属及特色材料加工重点实验室, 广西南宁 530004 |
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| 基金项目： | 国家自然科学基金(51161003,50661001,50061001)、广西自然科学重点基金(2012GXNSFDA053001)、广西大学广西有色金属及特色材料加工重点实验室开放基金(GXKFJ12-01)、2012年广西大学本科实验技能与科技创新能力训练项目、广西"新世纪教改工程"项目(编号:2011JGA096)资助。 |
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| 摘 要： | 采用晶体相场模型模拟小角度晶界结构和在外加应力作用下晶界、位错的演化过程,从位错的运动形式、体系自由能与应变关系等角度,讨论晶界位错运动和湮没过程。结果表明:在稳定的小角度晶界中,位错间距与位向差成反比。位错和晶界区域具有较高的能量密度;外加应力会导致一个位错组脱离晶界而分解成两个位错组,且有诱发晶界湮没的趋势;晶界湮没过程可以出现4个阶段或2个阶段,且存在敏感位向差角,位向差稍高于5.85°时晶界湮没过程呈4个阶段,位向差稍低于5.85°时晶界湮没过程呈2个阶段;位向差越小,晶界湮没过程越简单快捷。
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| 关 键 词： | 晶体相场模型 位向差 位错 晶界 |
| 收稿时间： | 2013-07-19 |
| 修稿时间： | 2013-09-30 |
Simulating Structure of Dislocation and Its Evolution in Low Angle Grain Boundary by Phase Field Crystal Method |
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| LU Cheng-jian,JIANG Li-ting,WANG Yu-ling,LUO Zhi-rong,HUANG Chuang-gao and GAO Ying-jun. Simulating Structure of Dislocation and Its Evolution in Low Angle Grain Boundary by Phase Field Crystal Method[J]. Guangxi Sciences, 2013, 20(4): 316-320 |
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| Authors: | LU Cheng-jian JIANG Li-ting WANG Yu-ling LUO Zhi-rong HUANG Chuang-gao GAO Ying-jun |
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| Affiliation: | College of Physics Science and Engineering, Guangxi University, Nanning, Guangxi, 530004, China;Institute of Physics Science and Engineering Technology, Yulin Normal University, Yulin, Guangxi, 537000, China,College of Physics Science and Engineering, Guangxi University, Nanning, Guangxi, 530004, China,College of Physics Science and Engineering, Guangxi University, Nanning, Guangxi, 530004, China,College of Physics Science and Engineering, Guangxi University, Nanning, Guangxi, 530004, China;Institute of Physics Science and Engineering Technology, Yulin Normal University, Yulin, Guangxi, 537000, China,College of Physics Science and Engineering, Guangxi University, Nanning, Guangxi, 530004, China;Ministry Key Laboratory for Non-ferrous Metal and Featured Materials, Nanning, Guangxi, 530004, China and College of Physics Science and Engineering, Guangxi University, Nanning, Guangxi, 530004, China;Ministry Key Laboratory for Non-ferrous Metal and Featured Materials, Nanning, Guangxi, 530004, China |
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| Abstract: | The phase field crystal model is employed to simulate the structure of low angle grain boundary and its dislocation evolution under an applied stress.The process of a dislocation motion and annihilation is discussed according to its movement and the relation between free energy and strain.The simulated results confirm that the dislocation spacing is inversely proportional to the misorientation angle.It shows that there is higher energy density in the region of dislocations and the grain boundaries than others.An applied stress can induce a double-array dislocation to separate from the grain boundary and split apart into two double-array dislocations and to trend to annihilate at grain boundary.The annihilation process contains four or two stages and also there is a sensitive angle. When misorientation angle is slightly higher than 5.85°the annihilation process contains four stages, while the annihilation process contains two stages when misorientation angle is slightly lower than 5.85°.The smaller the misorientation angle is, the faster the process of the grain boundary annihilation is. |
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| Keywords: | phase field crystal model misorientation dislocation grain boundary |
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