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research article

Band Gap of Atomically Precise Graphene Nanoribbons as a Function of Ribbon Length and Termination

Talirz, Leopold  
•
Sode, Hajo
•
Kawai, Shigeki
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August 21, 2019
Chemphyschem

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".

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Type
research article
DOI
10.1002/cphc.201900313
Web of Science ID

WOS:000482519600001

Author(s)
Talirz, Leopold  
Sode, Hajo
Kawai, Shigeki
Ruffieux, Pascal
Meyer, Ernst
Feng, Xinliang
Muellen, Klaus
Fasel, Roman
Pignedoli, Carlo A.
Passerone, Daniele
Date Issued

2019-08-21

Publisher

WILEY-V C H VERLAG GMBH

Published in
Chemphyschem
Volume

20

Issue

18

Start page

2348

End page

2353

Subjects

Chemistry, Physical

•

Physics, Atomic, Molecular & Chemical

•

Chemistry

•

Physics

•

microscope

Editorial or Peer reviewed

REVIEWED

Written at

EPFL

EPFL units
THEOS  
Available on Infoscience
September 6, 2019
Use this identifier to reference this record
https://infoscience.epfl.ch/handle/20.500.14299/160915
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