Magnetic Interactions Between Radical Pairs in Chiral Graphene Nanoribbons.
density functional theory
graphene nanoribbon
heteroatom substitution
magnetism
mean-field Hubbard model
scanning tunneling microscopy
spin interaction
Journal
Nano letters
ISSN: 1530-6992
Titre abrégé: Nano Lett
Pays: United States
ID NLM: 101088070
Informations de publication
Date de publication:
12 Jan 2022
12 Jan 2022
Historique:
pubmed:
23
12
2021
medline:
23
12
2021
entrez:
22
12
2021
Statut:
ppublish
Résumé
Open-shell graphene nanoribbons have become promising candidates for future applications, including quantum technologies. Here, we characterize magnetic states hosted by chiral graphene nanoribbons (chGNRs). The substitution of a hydrogen atom at the chGNR edge by a ketone effectively adds one
Identifiants
pubmed: 34936370
doi: 10.1021/acs.nanolett.1c03578
doi:
Types de publication
Journal Article
Langues
eng
Sous-ensembles de citation
IM