Strain Energies of Silicon Rings and Clusters
โ Scribed by Zhao, Ming; Gimarc, Benjamin M.
- Book ID
- 123611475
- Publisher
- American Chemical Society
- Year
- 1996
- Tongue
- English
- Weight
- 512 KB
- Volume
- 35
- Category
- Article
- ISSN
- 0020-1669
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
The Gaussian-2 (G2) theoretical procedure, based on ab initio molecular orbital theory, is used to calculate the energies of mixed triatomic clusters of carbon and silicon. The G2 energies are used to derive accurate binding energies which are compared with experimental values.
The ring strain energies of tetraphosphacubane and tetraarsacubane, along with their tetraoxide and tetrasulfide derivatives, were estimated at the MP2/6-31 G\* and MP2/LANL2DZ levels. The parents exhibit small strain energies, while the strain energy is quite large in the oxides and sulfides. These