• 文献标题:   Density functional theory calculations of the electric-field-induced Dirac cones and quantum valley Hall state in ABA-stacked trilayer graphene
  • 文献类型:   Article
  • 作  者:   LEE KW, LEE CE
  • 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:   Korea Univ
  • 被引频次:   4
  • DOI:   10.1103/PhysRevB.92.245416
  • 出版年:   2015

▎ 摘  要

We have investigated ABA-stacked trilayer graphene under a perpendicular electric field by using the density functional theory (DFT) calculations, which may contribute to the resolution of the discrepancies between experimental and theoretical results on the electric-field-induced band gap and topological phase transition. We found that the electric field opens a band gap at a low field and closes the gap at a high field, supporting one of the experimental results. While the seven electric-field-induced Dirac cones with mass gaps predicted in recent tight-binding (TB) models are confirmed, our DFT calculations demonstrate a phase transition from a quantum valley Hall insulator to a semimetal, contrasting to the TB model prediction of a topological phase transition between topologically nontrivial insulators at a high electric field.