• 文献标题:   Band Gap of Atomically Precise Graphene Nanoribbons as a Function of Ribbon Length and Termination
  • 文献类型:   Article
  • 作  者:   TALIRZ L, SDE H, KAWAI S, RUFFIEUX P, MEYER E, FENG XL, MLLEN K, FASEL R, PIGNEDOLI CA, PASSERONE D
  • 作者关键词:  
  • 出版物名称:   CHEMPHYSCHEM
  • ISSN:   1439-4235 EI 1439-7641
  • 通讯作者地址:   Empa
  • 被引频次:   4
  • DOI:   10.1002/cphc.201900313 EA AUG 2019
  • 出版年:   2019

▎ 摘  要

We study the band gap of finite NA=7 armchair graphene nanoribbons (7-AGNRs) on Au(111) through scanning tunneling microscopy/spectroscopy combined with density functional theory calculations. The band gap of 7-AGNRs with lengths of 8 nm and more is converged to within 50 meV of its bulk value of approximate to 2.3eV, while the band gap opens by several hundred meV in very short 7-AGNRs. We demonstrate that even an atomic defect, such as the addition of one hydrogen atom at the termini, has a significant effect - in this case, lowering the band gap. The effect can be captured in terms of a simple analytical model by introducing an effective "electronic length".