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Electronic Structure Of Optimized Si_{M}H_{N} Clusters: Mindo3 And Am1 Calculations, Şakir Erkoç, Lemi Türker
Electronic Structure Of Optimized Si_{M}H_{N} Clusters: Mindo3 And Am1 Calculations, Şakir Erkoç, Lemi Türker
Turkish Journal of Physics
We have investigated the electronic structure of optimized hydrogenated silicon microclusters. Si_{m}H_{n} (m=2,3,5,6; n = 4,6) have been investigated. The calculations were performed using both MINDO3 and AM1 semiempirical molecular orbital methods.