First-principles investigation of the site preference and alloying effect of Mo, Ta and platinum group metals in gamma '-Co-3(Al, W)
文献类型：期刊论文
| 作者 | Chen, Min2; Wang, Chong-Yu1,2 |
| 刊名 | SCRIPTA MATERIALIA
 |
| 出版日期 | 2009-04-01 |
| 卷号 | 60期号:8页码:659-662 |
| 关键词 | Platinum group Electronic structure Density functional Co-based alloys |
| ISSN号 | 1359-6462 |
| DOI | 10.1016/j.scriptamat.2008.12.040 |
| 通讯作者 | Chen, Min(min-chen05@mails.tsinghua.edu.cn) |
| 英文摘要 | The alloying effect of Mo, Ta and platinum group metals on the properties of gamma'-Co-3(Al, W) are studied using supercell models. It is demonstrated that Mo, Ta, Rh Ir and Pt can stabilize the gamma' phase, and three types of site preference are recognized. The binding energy and the lattice constant of the gamma' phase is modified and the distinct alloying effect of those elements is further revealed by investigating the impurity-induced charge density and the partial density of states. (C) 2009 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved. |
| 资助项目 | Ministry of Science and Technology of China[2006CB605102] |
| WOS研究方向 | Science & Technology - Other Topics ; Materials Science ; Metallurgy & Metallurgical Engineering |
| 语种 | 英语 |
| WOS记录号 | WOS:000264432800016 |
| 出版者 | PERGAMON-ELSEVIER SCIENCE LTD |
| 资助机构 | Ministry of Science and Technology of China |
| 源URL | [http://ir.imr.ac.cn/handle/321006/96262]  |
| 专题 | 金属研究所_中国科学院金属研究所 |
| 通讯作者 | Chen, Min |
| 作者单位 | 1.Chinese Acad Sci, Int Ctr Mat Phys, Shenyang 110016, Peoples R China 2.Tsinghua Univ, Dept Phys, Beijing 100084, Peoples R China |
| 推荐引用方式 GB/T 7714 | Chen, Min,Wang, Chong-Yu. First-principles investigation of the site preference and alloying effect of Mo, Ta and platinum group metals in gamma '-Co-3(Al, W)[J]. SCRIPTA MATERIALIA,2009,60(8):659-662. |
| APA | Chen, Min,&Wang, Chong-Yu.(2009).First-principles investigation of the site preference and alloying effect of Mo, Ta and platinum group metals in gamma '-Co-3(Al, W).SCRIPTA MATERIALIA,60(8),659-662. |
| MLA | Chen, Min,et al."First-principles investigation of the site preference and alloying effect of Mo, Ta and platinum group metals in gamma '-Co-3(Al, W)".SCRIPTA MATERIALIA 60.8(2009):659-662. |
入库方式： OAI收割
来源：金属研究所
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