• 文献标题:   Designing coved graphene nanoribbons with charge carrier mobility approaching that of graphene
  • 文献类型:   Article
  • 作  者:   CHEN LP, WANG LJ, BELJONNE D
  • 作者关键词:  
  • 出版物名称:   CARBON
  • ISSN:   0008-6223 EI 1873-3891
  • 通讯作者地址:   Univ Mons
  • 被引频次:   12
  • DOI:   10.1016/j.carbon.2014.05.091
  • 出版年:   2014

▎ 摘  要

Graphene nanoribbons (GNRs) are fundamental building blocks for carbon-based nanoelectronic devices. We focus here on coved-shape GNRs that contain protruding phenyl rings along both edges. Based on density functional theory calculations coupled to deformation potential theory, we show that these additional phenyl rings profoundly impact the nature of the electronic states near the Fermi surface and modulate the resulting charge transport characteristics of the ribbons. Exploiting Clar's theory, we design unit cells where the number and position of the edge phenyl groups are adjusted to maximize the hole or/and the electron mobility reaching values close to that of graphene. (C) 2014 Elsevier Ltd. All rights reserved.