• 文献标题:   Structure manipulation of graphene by hydrogenation
  • 文献类型:   Article
  • 作  者:   REDDY CD, ZHANG YW
  • 作者关键词:  
  • 出版物名称:   CARBON
  • ISSN:   0008-6223 EI 1873-3891
  • 通讯作者地址:   Inst High Performance Comp
  • 被引频次:   20
  • DOI:   10.1016/j.carbon.2013.11.062
  • 出版年:   2014

▎ 摘  要

Chemical functionalization is one of the most promising routes to manipulate the electronic properties of graphene. Through single-sided hydrogenation on graphene, quantized specific bending angles (from 00 to 180) can be obtained, thus providing a controllable knob to tune the hydrogenated structure. Using molecular dynamics simulations, we show that hydrogenation can be used to manipulate graphene into a variety of well-defined geometrical configurations by precisely controlling the size, location and direction of hydrogenation. This work suggests that hydrogenation is a possible route to achieve complex structures without cutting or joining process during graphene-based nanoelectronic device fabrication. (C) 2013 Elsevier Ltd. All rights reserved.