• 文献标题:   Thermal conductivity of fluorinated graphene: A non-equilibrium molecular dynamics study
  • 文献类型:   Article
  • 作  者:   HUANG WX, PEI QX, LIU ZS, ZHANG YW
  • 作者关键词:  
  • 出版物名称:   CHEMICAL PHYSICS LETTERS
  • ISSN:   0009-2614 EI 1873-4448
  • 通讯作者地址:   ASTAR
  • 被引频次:   39
  • DOI:   10.1016/j.cplett.2012.09.043
  • 出版年:   2012

▎ 摘  要

We investigate the thermal conductivity of fluorinated graphene using molecular dynamics simulations. We find that fluorination reduces the thermal conductivity of graphene, with the amount of reduction strongly depending on both distribution and coverage of fluorination. The thermal conductivity shows a somewhat U-shaped change with coverage from 0% to 100%. At the same coverage, random fluorination results in a larger reduction in thermal conductivity than patterned fluorination, and the patterned strips oriented perpendicular to heat flux cause a stronger reduction than the strips parallel to heat flux. We also find that fluorination makes the thermal conductivity less sensitive to strain. (C) 2012 Elsevier B.V. All rights reserved.