Energy-band structure of SiC polytypes by interface matching of electronic wave functions

W. H. Backes, P. A. Bobbert, and W. van Haeringen
Phys. Rev. B 49, 7564 – Published 15 March 1994
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Abstract

We interpret SiC polytypes as natural superlattices, consisting of mutually twisted cubic layers. A method is presented to calculate the electron band structure of any polytype, based on an empirical pseudopotential description of cubic SiC. Bloch and evanescent waves, belonging to cubic layers are matched at interfaces in order to make up the wave functions of the respective polytypes. Band gaps of hexagonal and rhombohedral modifications are in excellent agreement with experimental data such that the nearly linear relationship between the indirect gap and the hexagonal nature is reproduced. A simple explanation of this relationship is given in terms of a Kronig-Penney-like model.

  • Received 13 October 1993

DOI:https://doi.org/10.1103/PhysRevB.49.7564

©1994 American Physical Society

Authors & Affiliations

W. H. Backes, P. A. Bobbert, and W. van Haeringen

  • Eindhoven University of Technology, Department of Physics, P.O. Box 513, 5600 MB Eindhoven, The Netherlands

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Vol. 49, Iss. 11 — 15 March 1994

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