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Stability and Reconstruction of, β-SiC (100) Surfaces

Published online by Cambridge University Press:  15 February 2011

R. Gutierrez  and
Th. Frauenheim
R. Gutierrez
Affiliation:
Theoretische Physik III, Technische Universität, 09107 Chemnitz, Germany
Th. Frauenheim
Affiliation:
Theoretische Physik III, Technische Universität, 09107 Chemnitz, Germany
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Abstract

We present a detailed investigation of β-SiC (100) surface reconstructions. Minimal energy configurations at both C- and Si-terminations are determined by using a density-functional based molecular-dynamics method. We provide information on the energetic order of various metastable surfaces and describe the geometrical details. In addition, we also study Si- and C-enriched configurations.

Type
Research Article
Information
MRS Online Proceedings Library (OPL) , Volume 423: Symposium E – III-Nitride, SiC, and Diamond Materials for Electronic , 1996 , 427
Copyright
Copyright © Materials Research Society 1996

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