Dergiler / Turkish Journal of Physics / 1998 / Cilt: 22 - Sayı: 11
Electronic Structure of Optimized SimHn Clusters: MINDO3 and AM1 Calculations
- Sayfa
- 1069–1076
- DOI
- —
Özet
We have investigated the electronic structure of optimized hydrogenated silicon microclusters. SimHn (m=2,3,5,6; n = 4,6) have been investigated. The calculations were performed using both MINDO3 and AM1 semiempirical molecular orbital methods.
Abstract
We have investigated the electronic structure of optimized hydrogenated silicon microclusters. SimHn (m=2,3,5,6; n = 4,6) have been investigated. The calculations were performed using both MINDO3 and AM1 semiempirical molecular orbital methods.