The possible geometrical structures and relative stability of silicon-sulfur clusters (SiS 2 ) (n = 1-6) are explored by means of density functional theory (DFT) quantum chemical calculations. We also compare DFT with second-order Møller-Plesset (MP2) and Hartree-Fock (HF) methods. The effects of po
✦ LIBER ✦
Theoretical study of the structural evolution of small hydrogenated silicon clusters: Si6Hx
✍ Scribed by Takehide Miyazaki; Tsuyoshi Uda; Ivan Štich; Kiyoyuki Terakura
- Book ID
- 107736688
- Publisher
- Elsevier Science
- Year
- 1996
- Tongue
- English
- Weight
- 481 KB
- Volume
- 261
- Category
- Article
- ISSN
- 0009-2614
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