• 文献标题:   The core structure and pseudo-magnetic field of the dislocation in graphene
  • 文献类型:   Article
  • 作  者:   WANG SF, WANG R
  • 作者关键词:  
  • 出版物名称:   EPL
  • ISSN:   0295-5075 EI 1286-4854
  • 通讯作者地址:   Chongqing Univ
  • 被引频次:   6
  • DOI:   10.1209/0295-5075/104/26002
  • 出版年:   2013

▎ 摘  要

An analytical theory is presented for the dislocation (pentagon-heptagon pair) in graphene. In order to fully determine the nonlinear interaction which is responsible for the appearance of dislocation, a gamma-potential is proposed and calculated from the electron-density functional theory. The improved dislocation equation, which takes into account the change in space between the mismatched chains, is solved by the variational principle. The strain and stress, in particular the change in the bond length and bond angle at the dislocation core, are obtained explicitly and verified by the first-principle calculation. The pseudo-magnetic field felt by electrons at the band edge is investigated including contribution from topology as well as deformation. Copyright (C) EPLA, 2013