检索结果-南通市图书馆

nucleation and growth of L1_(2)-Al_(3)RE particles in aluminum alloys:A first-principles study

Journal of Rare Earths 2023年第7期41卷 1116-1126,I0005页

作者： Touwen Fan Zixiong Ruan Feng Zhong Chaoyang Xie Xiaofeng Li Dongchu Chen Pingying Tang Yuanzhi Wu College of Science Hunan Institute of TechnologyHengyang 421002China Research Institute of Automobile Parts Technology Hunan Institute of TechnologyHengyang 421002China School of Materials Science and Engineering North University of Chin1Taiyuan 030051China School of Material Science and Hydrogen Energy Engineering Foshan UniversityFoshan 528001China Key Laboratory of New Electric Functional Materials of Guangxi Colleges and Universities Nanning Normal UniversityNanning 530023China

The internal mechanisms of nucleation and growth of L1_(2)-AI_(3)RE(RE=Sc,Y,La-Lu) second phases in Al alloys were investigated by combining first-principles calculations with quasi-harmonic approximation(QHA).The calculated results show that the diffusion rate D_s and chemical potential AG_V increase with the increase of temperature.With the increase of atomic number,the D_s and the strain energy ΔE_(CS)increase firstly from Sc to La,and then decreases,while the calculated interface energy γ_(α/β) and ΔG_V show opposite tendency.Based on above calculated results,the critical nucleation radius R*and coarsening rate K_(LSW) are obtained from the classical nucleation theory(CNT) and LSW model of the Ostwald ripening of particles,respectively.With the increase of atomic number,the R*increases firstly,and then decreases for all planes at finite temperatures.Whereas the K_(LSW) shows opposite variation to the R^(*).From this point of view,it is reasonably speculated that Y and later RE elements can replace the expensive Sc for heat-resistance Al alloys.The solubility c_(∞) of particles is usually very small at low temperature,and there is obvious solubility only when the temperature reaches 600 K.The surface energies E_(sur) of AI_(3)RE compounds and Al solid solution are respectively larger and smaller than that of pure Al,respectively,except for the surface(001) and(110) of Al_(3)La.For all planes,with the increase of atomic number of RE,E_(sur) decreases firstly from Sc to La,and then increases linearly to Lu.These results are helpful for designing high performance heat-resistance Al alloys.

关键词： First-principles calculations Diffusion rate Quasi-harmonic approximation particle nucleation and growth Rare earths

来源：

维普期刊数据库

同方期刊数据库评论

在线全文

学校读者我要写书评

暂无评论

欢迎您,

建议与咨询留下您的常用邮箱和电话号码，以便我们向您反馈解决方案和替代方法

时间限定

文献类型

馆藏选择

核心期刊

语言

文献类型

帮助

文字说明：

检索规则说明：

检索范例：

分类表

所选分类

限定检索结果

文献类型

馆藏范围

日期分布

学科分类号

主题

机构

作者

语言

在线全文

请选择保存的检索档案：

请选择收藏分类：

通借通还

欢迎您,

建议与咨询 留下您的常用邮箱和电话号码，以便我们向您反馈解决方案和替代方法

时间限定

文献类型

馆藏选择

核心期刊

语言

文献类型

帮助

文字说明：

检索规则说明：

检索范例：

分类表

所选分类

限定检索结果

文献类型

馆藏范围

日期分布

学科分类号

主题

机构

作者

语言

在线全文

请选择保存的检索档案： 新增检索档案 确定 取消

请选择收藏分类： 新增自定义分类 确定 取消

通借通还

建议与咨询留下您的常用邮箱和电话号码，以便我们向您反馈解决方案和替代方法

请选择保存的检索档案：

请选择收藏分类：