| Symmetry analysis of the electronic structure of polyhedron clusters M12 (O) and M60(Ih) | |
|---|---|
| 學年 | 79 |
| 學期 | 2 |
| 出版（發表）日期 | 1991-06-20 |
| 作品名稱 | Symmetry analysis of the electronic structure of polyhedron clusters M12 (O) and M60(Ih) |
| 作品名稱（其他語言） | |
| 著者 | Wang, Bo-cheng; Chiu, Ying-Nan |
| 單位 | 淡江大學化學學系 |
| 出版者 | Amsterdam: Elsevier BV |
| 著錄名稱、卷期、頁數 | Journal of Molecular Structure: Theochem 231, pp.1-20 |
| 摘要 | Computer programs are written to generate symmetry-adapted molecular orbitals and exact geometric relationships for atomic overlap integrals for polyhedral clusters with many vertices: M12(cuboctahedron, Oh), M12(icosahedron, Ih) and M60(icosahedron, Ih). In these clusters M may be boron, carbon or transition metal atoms and the atomic orbitals involved may be s, p or d orbitais. Explicit molecular orbitais (including normalization constants) and their energies in Mulliken-Wolfsberg-Hehmholz approximations are given. |
| 關鍵字 | |
| 語言 | en |
| ISSN | 0166-1280 1872-8014 |
| 期刊性質 | 國外 |
| 收錄於 | |
| 產學合作 | |
| 通訊作者 | |
| 審稿制度 | |
| 國別 | NLD |
| 公開徵稿 | |
| 出版型式 | 紙本 |
| 相關連結 |
機構典藏連結 ( http://tkuir.lib.tku.edu.tw:8080/dspace/handle/987654321/25279 ) |
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