• 文献标题:   Modifications in graphene electron states due to a deposited lattice of Au nanoparticles: Density functional calculations
  • 文献类型:   Article
  • 作  者:   CARARA SS, BATISTA RJC, CHACHAM H
  • 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 Fed Minas Gerais
  • 被引频次:   16
  • DOI:   10.1103/PhysRevB.80.115435
  • 出版年:   2009

▎ 摘  要

We perform first-principles investigations of two-dimensional, triangular lattices of Au-38 nanoparticles deposited on a graphene layer. We find that lattices of thiolate-covered nanoparticles cause electronic structure modifications in graphene such as minigaps, charge transfer, and new Dirac points, but graphene remains metallic. In contrast, for a moderate coverage of nanoparticles (approximate to 0.2 nm(-2)), a lattice of bare (noncovered) Au nanoparticles may induce periodic deformations on the graphene layer leading to the opening of a band gap of a few tens of meV at the Dirac point, in such a way that a properly charged system might become a semiconductor.