• 文献标题:   Nonlocal exchange interaction removes half-metallicity in graphene nanoribbons
  • 文献类型:   Article
  • 作  者:   RUDBERG E, SALEK P, LUO Y
  • 作者关键词:  
  • 出版物名称:   NANO LETTERS
  • ISSN:   1530-6984 EI 1530-6992
  • 通讯作者地址:   Royal Inst Technol
  • 被引频次:   158
  • DOI:   10.1021/nl070593c
  • 出版年:   2007

▎ 摘  要

Band gap studies of zigzag-edge graphene ribbons are presented. While earlier calculations at LDA level show that zigzag-edge graphene ribbons become half-metallic when cross-ribbon electric fields are applied, our calculations with hybrid density functional demonstrate that finite graphene ribbons behave as half-semiconductors. The spin-dependent band gap can be changed in a wide range, making possible many applications in spintronics.