Modifications in graphene electron states due to a deposited lattice of Au nanoparticles: Density functional calculations

Sabrina S. Carara, Ronaldo J. C. Batista, and Hélio Chacham
Phys. Rev. B 80, 115435 – Published 29 September 2009

Abstract

We perform first-principles investigations of two-dimensional, triangular lattices of Au38 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 (0.2nm2), 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.

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  • Received 28 March 2009

DOI:https://doi.org/10.1103/PhysRevB.80.115435

©2009 American Physical Society

Authors & Affiliations

Sabrina S. Carara1, Ronaldo J. C. Batista2, and Hélio Chacham1,*

  • 1Departamento de Física, ICEX, Universidade Federal de Minas Gerais, CP 702, 30123-970 Belo Horizonte, MG, Brazil
  • 2Departamento de Física, Universidade Federal de Ouro Preto, Campus Morro do Cruzeiro, 35400-000 Ouro Preto, MG, Brazil

  • *chacham@fisica.ufmg.br

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Vol. 80, Iss. 11 — 15 September 2009

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