"JOURNAL OF RADIO ELECTRONICS"  N 8, 2011

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QUANTUM ENERGY AND KINETIC PROPERTIES OF SILICON NANOELECTRONICS MATERIALS BASED ON CLUSTERS Si2-Si10

 

A. N. Vlasov, V. V. Filippov
Lipetsk state pedagogical university, faculty of physics

Received June 27, 2011, after additions - August 22, 2011

 

Abstract. The analysis of quantum chemical methods for calculating the structural, energy and transport parameters of silicon nanoparticles. The effect of the charge structure on the physical parameters of the nanoparticles determine the properties of charge transfer. It is shown that for a qualitative assessment of the properties of stability, geometry and electronic structure of silicon nanoparticles can use the method NDDO PM3. The results of optimization of atomic structure, calculation and analysis of electronic properties of silicon clusters Si2-Si10 method PM3.

Keywords: semiconductor nanoparticles, silicon, quantum-chemical methods, the energy characteristics.