• 文献标题:   Enhanced stability of hydrogen atoms at the graphene/graphane interface of nanoribbons
  • 文献类型:   Article
  • 作  者:   AO ZM, HERNANDEZNIEVES AD, PEETERS FM, LI S
  • 作者关键词:  
  • 出版物名称:   APPLIED PHYSICS LETTERS
  • ISSN:   0003-6951
  • 通讯作者地址:   Univ New S Wales
  • 被引频次:   40
  • DOI:   10.1063/1.3525377
  • 出版年:   2010

▎ 摘  要

The thermal stability of graphene/graphane nanoribbons (GGNRs) is investigated using density functional theory. It is found that the energy barriers for the diffusion of hydrogen atoms on the zigzag and armchair interfaces of GGNRs are 2.86 and 3.17 eV, respectively, while the diffusion barrier of an isolated H atom on pristine graphene was only similar to 0.3 eV. These results unambiguously demonstrate that the thermal stability of GGNRs can be enhanced significantly by increasing the hydrogen diffusion barriers through graphene/graphane interface engineering. This may provide new insights for viable applications of GGNRs. (C) 2010 American Institute of Physics. [doi:10.1063/1.3525377]