Electronic structure and mechanical stability of the graphitic honeycomb lattice

Noejung Park and Jisoon Ihm
Phys. Rev. B 62, 7614 – Published 15 September 2000
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Abstract

A family of crystal structures of carbon composed of alternating sp2 and sp3 bonds is investigated. Graphitic strips are connected by sp3 bonds to form an array of hexagonal pillars exhibiting a honeycomb lattice in the perpendicular plane. The electronic structure and elastic properties of this family of structures are calculated using an ab initio pseudopotential as well as the environment-dependent tight-binding method. Their electronic structure has a similar size dependence to zigzag nanotubes; they are metallic if twice the strip width is a multiple of three hexagonal units, and otherwise semiconducting with a wider range of the band gap than for carbon nanotubes. The structural stability is studied and compared with other carbon structures.

  • Received 3 March 2000

DOI:https://doi.org/10.1103/PhysRevB.62.7614

©2000 American Physical Society

Authors & Affiliations

Noejung Park and Jisoon Ihm

  • Department of Physics, Seoul National University, Seoul 151-742, Korea

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Issue

Vol. 62, Iss. 11 — 15 September 2000

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