• 文献标题:   Electronic structure of graphene: (Nearly) free electron bands versus tight-binding bands
  • 文献类型:   Article
  • 作  者:   KOGAN E, SILKIN VM
  • 作者关键词:   band structure, electronic structure, graphene, group theory, symmetry, tight binding
  • 出版物名称:   PHYSICA STATUS SOLIDI BBASIC SOLID STATE PHYSICS
  • ISSN:   0370-1972 EI 1521-3951
  • 通讯作者地址:   Bar Ilan Univ
  • 被引频次:   4
  • DOI:   10.1002/pssb.201700035
  • 出版年:   2017

▎ 摘  要

In our previous paper [Phys. Rev. B 89, 165430 (2014)] we have found that in graphene, in distinction to the four occupied bands, which can be described by the simple tight-binding model (TBM) with four atomic orbitals per atom, the two lowest lying at the Gamma-point unoccupied bands (one of them of a sigma type and the other of a pi type) can not be described by such model. In the presentwork, we suggest a minimalistic model for these two bands, based on (nearly) free electron model (FEM), which correctly describes the symmetry of these bands, their dispersion law and their localization with respect to the graphene plane. (C) 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim