• 文献标题:   Non-hexagonal symmetry-induced functional T graphene for the detection of carbon monoxide
  • 文献类型:   Article
  • 作  者:   LIU CS, JIA R, YE XJ, ZENG Z
  • 作者关键词:  
  • 出版物名称:   JOURNAL OF CHEMICAL PHYSICS
  • ISSN:   0021-9606 EI 1089-7690
  • 通讯作者地址:   Nanjing Univ
  • 被引频次:   11
  • DOI:   10.1063/1.4813528
  • 出版年:   2013

▎ 摘  要

Unlike on hexagonal graphene where Li atoms tend to cluster, using density functional theory, we demonstrate that Li atoms remain isolated on tetrasymmetrical T graphene due to a nonuniform charge distribution in T graphene. Furthermore, we examine the adsorption of several common gas molecules and find that Li-decorated T graphene exhibits a high sensitivity to CO. The CO adsorption strength can be manipulated by an external electric field, resulting in a short recovery time. Our results provide an insight to build promising nanosensors based on two-dimensional carbonic materials beyond hexagonal symmetry. (C) 2013 AIP Publishing LLC.