First-principle study of Mg adsorption on Si(111) surfaces
文献类型:期刊论文
作者 | Ying, MJ ; Zhang, P ; Du, XL |
刊名 | CHINESE PHYSICS B
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出版日期 | 2009 |
卷号 | 18期号:1页码:275 |
关键词 | MOLECULAR-BEAM EPITAXY AUGMENTED-WAVE METHOD MG/SI(111) SYSTEM TRANSITION NA |
ISSN号 | 1674-1056 |
通讯作者 | Ying, MJ: Beijing Normal Univ, Minist Educ, Key Lab Beam Technol & Mat Modificat, Beijing 100875, Peoples R China. |
中文摘要 | We have carried out first-principle calculations of Mg adsorption on Si(111) surfaces. Different adsorption sites and coverage effects have been considered. We found that the threefold hollow adsorption is energy-favoured in each coverage considered, while for the clean Si(111) surface of metallic feature, we found that 0.25 and 0.5 ML Mg adsorption leads to a semiconducting surface. The results for the electronic behaviour suggest a polarized covalent bonding between the Mg adatom and Si(111) surface. |
收录类别 | SCI |
语种 | 英语 |
公开日期 | 2013-09-17 |
源URL | [http://ir.iphy.ac.cn/handle/311004/38224] ![]() |
专题 | 物理研究所_物理所公开发表论文_物理所公开发表论文_期刊论文 |
推荐引用方式 GB/T 7714 | Ying, MJ,Zhang, P,Du, XL. First-principle study of Mg adsorption on Si(111) surfaces[J]. CHINESE PHYSICS B,2009,18(1):275. |
APA | Ying, MJ,Zhang, P,&Du, XL.(2009).First-principle study of Mg adsorption on Si(111) surfaces.CHINESE PHYSICS B,18(1),275. |
MLA | Ying, MJ,et al."First-principle study of Mg adsorption on Si(111) surfaces".CHINESE PHYSICS B 18.1(2009):275. |
入库方式: OAI收割
来源:物理研究所
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