• 文献标题:   Electronic and thermoelectric properties of assembled graphene nanoribbons with elastic strain and structural dislocation
  • 文献类型:   Article
  • 作  者:   LIANG LB, MEUNIER V
  • 作者关键词:  
  • 出版物名称:   APPLIED PHYSICS LETTERS
  • ISSN:   0003-6951 EI 1077-3118
  • 通讯作者地址:   Rensselaer Polytech Inst
  • 被引频次:   24
  • DOI:   10.1063/1.4800777
  • 出版年:   2013

▎ 摘  要

Graphene nanowiggles (GNWs) are one-dimensional wiggle edged graphene nanoribbons (GNRs) that have been synthesized using an atomically precise bottom-up approach. They are known to possess superior thermoelectric properties compared to straight GNRs. Here, first-principles density functional theory calculations establish that these properties can be further enhanced when they undergo a structural dislocation. While such plastic deformation raises the figure of merit ZT above 1 at room temperature, an elastic deformation under uniaxial tension does not increase ZT. The calculations also show that the GNWs possess a Young's modulus (0.82 TPa) smaller than that of their straight GNR counterparts (1.08 TPa). (C) 2013 American Institute of Physics.