• 文献标题:   Strain effect on the electronic and transport properties of monolayer hybrid zigzag graphene nanoribbon formed with graphane and fluorographane: Insight from first-principles calculations
  • 文献类型:   Article
  • 作  者:   RI NC, KIM JC, WI JH, RI SI
  • 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:   Inst Phys
  • 被引频次:   0
  • DOI:   10.1016/j.cplett.2020.137815
  • 出版年:   2020

▎ 摘  要

We investigate the electronic and transport properties of hybrid ZGNRs under applied strain, which are formed by simultaneously substituting GANR's and FGANR's into both edge parts of ZGNRs, using density functional theory and nonequilibrium Green's function techniques. The calculated results reveal that all systems are structurally stable and their electronic and transport characteristics can be significantly modulated according to strain and nanoroad. In particular, the strain dependence of GA(3)/FGA(3) system experiences the semiconductor with wide direct band gap of about 1.37-3.62 eV. Importantly, the calculated I-V curves of GA(2)/ZG(2)/FGA(2) as a function of strain exhibit negative differential resistance.