期刊論文
| 學年 | 88 |
|---|---|
| 學期 | 1 |
| 出版（發表）日期 | 2000-01-01 |
| 作品名稱 | Density functional study of structural and electronic properties of silane adsorbed Si(100) surface |
| 作品名稱（其他語言） | |
| 著者 | 林志興; Lin, Jyh-shing; Chen, Cheng-ji; Lee, Ming-hsien; Lee, Kuo-hwa; Kuo, Yu-tzu |
| 單位 | 淡江大學化學學系 |
| 出版者 | |
| 著錄名稱、卷期、頁數 | Journal of Molecular Structure : Theochem496, pp.163-174 |
| 摘要 | Ab initio total energy calculations based on a norm-conserving optimized pseudopotential and density functional theory with a generalized gradient approximation (GGA) have been used to study the structures and energetics in connection with Si(100) surface and the silane (SiH4) adsorbed Si(100) surface. The electronic properties, i.e. layer-resolved density of state and atomic-resolved density of state, of Si(100)-(2×2) surface and Si(100)-(2×2) (SiH3:H) surface have been calculated. The surface electronic states arising from the buckled SiSi dimer are characterized to illustrate the bonding nature of Si(100)-(2×2) and Si(100)-(2×2) (SiH3:H). |
| 關鍵字 | Density functional theory;Pseudopotential;Chemical vapor deposition;Silane;Si(100) surface;Density of state |
| 語言 | en |
| ISSN | |
| 期刊性質 | 國內 |
| 收錄於 | |
| 產學合作 | |
| 通訊作者 | |
| 審稿制度 | 否 |
| 國別 | TWN |
| 公開徵稿 | |
| 出版型式 | ,電子版 |
| 相關連結 |
機構典藏連結 ( http://tkuir.lib.tku.edu.tw:8080/dspace/handle/987654321/61553 ) |