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A structural stability diagram of multiple vacancies and defect self-healing in graphene

Author(s)
Wang, LuYan, FengChan, Helen L. W.Ding, Feng
Issued Date
2012
DOI
10.1039/c2nr32308g
URI
https://scholarworks.unist.ac.kr/handle/201301/31375
Fulltext
https://pubs.rsc.org/en/content/articlelanding/2012/NR/c2nr32308g#!divAbstract
Citation
NANOSCALE, v.4, no.23, pp.7489 - 7493
Abstract
Various types of multiple vacancies (MVs) in graphene nanoribbons (GNRs) and graphene are explored by quantum calculations. It is surprising that their relative stabilities highly depend on the width of the GNRs and thus is significantly different from those in graphene. A diagram of various MVs in GNRs is drawn and it is predicated that the hole in both GNRs and graphene can be annihilated. A new type of the MVs, which contains pentagon pairs and octagons (5/5 vertical bar 8), shows exceptional stability in GNRs. This study reveals the uniqueness of GNRs and a mechanism of defect self-healing in GNRs and graphene.
Publisher
ROYAL SOC CHEMISTRY
ISSN
2040-3364
Keyword
WALLED CARBON NANOTUBESNANORIBBONS

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