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Alloying element's substitution in titanium alloy with improved oxidation resistance and enhanced magnetic properties 期刊论文
JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS, 2017, 卷号: 422, 页码: 20-24
作者:  Yu, Ang-Yang;  Wei, Hua;  Hu, Qing-Miao;  Yang, Rui;  Yu, AY (reprint author), Chinese Acad Sci, Inst Met Res, Shenyang 110016, Peoples R China.
收藏  |  浏览/下载：96/0  |  提交时间：2017/08/17
First-principles  Ti/tio2 Interface  Magnetic Properties  Segregation  Oxidation Resistance  
The ground state and low-lying excited states of CCCN radical and its ions: a CASSCF/CASPT2 study 期刊论文
CANADIAN JOURNAL OF PHYSICS, 2016, 卷号: 94, 期号: 9, 页码: 803-807
作者:  Yu, AY;  Yu, AY (reprint author), Chinese Acad Sci, Inst Met Res, Shenyang 110016, Peoples R China.
收藏  |  浏览/下载：119/0  |  提交时间：2016/12/28
Cccn Radical  Ground State  Low-lying Excited States  Complete Active Space Self-consistent Field  Multi-configuration Second-order Perturbation Theory  
How does the extent of substitution of methane with chlorine influence the mechanism and kinetics of the reactions between chloromethanes and atomic chlorine 期刊论文
KINETICS AND CATALYSIS, 2016, 卷号: 57, 期号: 2, 页码: 145-153
作者:  Yu, A. Y.;  Hu, Q. M.;  Yang, R.;  Yu, AY (reprint author), Chinese Acad Sci, Inst Met Res, 72 Wenhua Rd, Shenyang 110016, Liaoning, Peoples R China.
收藏  |  浏览/下载：93/0  |  提交时间：2016/08/22
Rate Coefficients  Variational Transition State Theory  Hydrogen Abstraction  Reaction Pathway