Elastic constants and anisotropy of RuB(2) under pressure
文献类型:期刊论文
作者 | F. Luo ; M. Fu ; G. F. Ji ; X. R. Chen |
刊名 | Chinese Physics B
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出版日期 | 2010 |
卷号 | 19期号:2 |
关键词 | elastic properties density functional theory RuB(2) 1st-principles calculations electronic-structure ab-initio superconductivity crystals osb2 temperature diborides dynamics borides |
ISSN号 | 1674-1056 |
中文摘要 | The structural, elastic constants and anisotropy of RuB(2) under pressure are investigated by first-principles calculations based on the plane wave pseudopotential density functional theory method within the local density approximation (LDA) as well as the generalized gradient approximation (GGA) for exchange and correlation. The results accord well with the available experimental and other theoretical data. The elastic constants, elastic anisotropy, and Debye temperature circle minus as a function of pressure are presented. It is concluded that RuB(2) is brittle in nature at low pressure, whereas it becomes ductile at higher pressures. An analysis for the calculated elastic constant has been made to reveal the mechanical stability of RuB(2) up to 100 GPa. |
原文出处 | |
公开日期 | 2012-04-13 |
源URL | [http://ir.imr.ac.cn/handle/321006/31351] ![]() |
专题 | 金属研究所_中国科学院金属研究所 |
推荐引用方式 GB/T 7714 | F. Luo,M. Fu,G. F. Ji,et al. Elastic constants and anisotropy of RuB(2) under pressure[J]. Chinese Physics B,2010,19(2). |
APA | F. Luo,M. Fu,G. F. Ji,&X. R. Chen.(2010).Elastic constants and anisotropy of RuB(2) under pressure.Chinese Physics B,19(2). |
MLA | F. Luo,et al."Elastic constants and anisotropy of RuB(2) under pressure".Chinese Physics B 19.2(2010). |
入库方式: OAI收割
来源:金属研究所
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