Tight-binding description of graphene

S. Reich, J. Maultzsch, C. Thomsen, and P. Ordejón
Phys. Rev. B 66, 035412 – Published 19 July 2002
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Abstract

We investigate the tight-binding approximation for the dispersion of the π and π* electronic bands in graphene and carbon nanotubes. The nearest-neighbor tight-binding approximation with a fixed γ0 applies only to a very limited range of wave vectors. We derive an analytic expression for the tight-binding dispersion including up to third-nearest neighbors. Interaction with more distant neighbors qualitatively improves the tight-binding picture, as we show for graphene and three selected carbon nanotubes.

  • Received 22 April 2002

DOI:https://doi.org/10.1103/PhysRevB.66.035412

©2002 American Physical Society

Authors & Affiliations

S. Reich, J. Maultzsch, and C. Thomsen

  • Institut für Festkörperphysik, Technische Universität Berlin, Hardenbergstrasse 36, 10623 Berlin, Germany

P. Ordejón

  • Institut de Ciència de Materials de Barcelona (CSIC), Campus de la U.A.B. E-08193 Bellaterra, Barcelona, Spain

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Vol. 66, Iss. 3 — 15 July 2002

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