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First-Principles Study on Free Energy and Elastic Properties of Disordered beta-Ti1-xNbx Alloy: Comparison Between SQS and CPA 期刊论文
ACTA METALLURGICA SINICA, 2020, 卷号: 56, 期号: 9, 页码: 1304-1312
作者:  Zhang Haijun;  Qiu Shi;  Sun Zhimei;  Hu Qingmiao;  Yang Rui
收藏  |  浏览/下载：187/0  |  提交时间：2021/02/02
titanium alloy  random solid solution  special quasirandom structure  coherent potential approximation  elastic constant  first-principles calculation  
Elastic constants of random solid solutions by SQS and CPA approaches: the case of fcc Ti-Al 期刊论文
JOURNAL OF PHYSICS-CONDENSED MATTER, 2015, 卷号: 27, 期号: 31, 页码: -
作者:  Tian, Li-Yun;  Hu, Qing-Miao;  Yang, Rui;  Zhao, Jijun;  Johansson, Borje;  Vitos, Levente;  qmhu@imr.ac.cn
收藏  |  浏览/下载：165/0  |  提交时间：2016/04/21
Random Solid Solution  Elastic Constant  Density Functional Theory