• 文献标题:   Ab initio theory of gate induced gaps in graphene bilayers
  • 文献类型:   Article
  • 作  者:   MIN HK, SAHU B, BANERJEE SK, MACDONALD AH
  • 作者关键词:  
  • 出版物名称:   PHYSICAL REVIEW B
  • ISSN:   1098-0121 EI 1550-235X
  • 通讯作者地址:   Univ Texas
  • 被引频次:   400
  • DOI:   10.1103/PhysRevB.75.155115
  • 出版年:   2007

▎ 摘  要

We study the gate-voltage induced gap that occurs in graphene bilayers using ab initio density functional theory. Our calculations confirm the qualitative picture suggested by phenomenological tight-binding and continuum models. We discuss enhanced screening of the external interlayer potential at small gate voltages, which is more pronounced in the ab initio calculations, and quantify the role of crystalline inhomogeneity using a tight-binding model self-consistent Hartree calculation.