Repository logo

Infoscience

  • English
  • French
Log In
Logo EPFL, École polytechnique fédérale de Lausanne

Infoscience

  • English
  • French
Log In
  1. Home
  2. Academic and Research Output
  3. Journal articles
  4. Five-Membered Rings Create Off-Zero Modes in Nanographene
 
research article

Five-Membered Rings Create Off-Zero Modes in Nanographene

Jacobse, Peter H.
•
Daugherty, Michael C.
•
Cernevics, Kristians  
Show more
December 5, 2023
Acs Nano

The low-energy electronic structure of nanographenes can be tuned through zero-energy pi-electron states, typically referred to as zero-modes. Customizable electronic and magnetic structures have been engineered by coupling zero-modes through exchange and hybridization interactions. Manipulation of the energy of such states, however, has not yet received significant attention. We find that attaching a five-membered ring to a zigzag edge hosting a zero-mode perturbs the energy of that mode and turns it into an off-zero mode: a localized state with a distinctive electron-accepting character. Whereas the end states of typical 7-atom-wide armchair graphene nanoribbons (7-AGNRs) lose their electrons when physisorbed on Au(111) (due to its high work function), converting them into off-zero modes by introducing cyclopentadienyl five-membered rings allows them to retain their single-electron occupation. This approach enables the magnetic properties of 7-AGNR end states to be explored using scanning tunneling microscopy (STM) on a gold substrate. We find a gradual decrease of the magnetic coupling between off-zero mode end states as a function of GNR length, and evolution from a more closed-shell to a more open-shell ground state.

  • Details
  • Metrics
Type
research article
DOI
10.1021/acsnano.3c06006
Web of Science ID

WOS:001136361000001

Author(s)
Jacobse, Peter H.
•
Daugherty, Michael C.
•
Cernevics, Kristians  
•
Wang, Ziyi
•
McCurdy, Ryan D.
•
Yazyev, Oleg V.  
•
Fischer, Felix R.
•
Crommie, Michael F.
Date Issued

2023-12-05

Publisher

Amer Chemical Soc

Published in
Acs Nano
Volume

17

Issue

24

Start page

24901

End page

24909

Subjects

Physical Sciences

•

Technology

•

Nanographenes

•

Five-Memberedrings

•

Electronicstructure

•

Magnetic Ground State

•

Open Shell

•

Zero-Modes

•

Scanning Tunneling Microscopy

Peer reviewed

REVIEWED

Written at

EPFL

EPFL units
C3MP  
FunderGrant Number

Nederlandse Organisatie voor Wetenschappelijk Onderzoek

DE-AC02-05-CH11231

US Department of Energy (DOE), Office of Science, Basic Energy Sciences (BES), Materials Sciences and Engineering Division

N00014-19-1-2503

Office of Naval Research

CHE-2204252

Show more
Available on Infoscience
February 20, 2024
Use this identifier to reference this record
https://infoscience.epfl.ch/handle/20.500.14299/204890
Logo EPFL, École polytechnique fédérale de Lausanne
  • Contact
  • infoscience@epfl.ch

  • Follow us on Facebook
  • Follow us on Instagram
  • Follow us on LinkedIn
  • Follow us on X
  • Follow us on Youtube
AccessibilityLegal noticePrivacy policyCookie settingsEnd User AgreementGet helpFeedback

Infoscience is a service managed and provided by the Library and IT Services of EPFL. © EPFL, tous droits réservés