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First-principles study of graphene edge properties and flake shapes

✍ Scribed by Gan, Chee Kwan; Srolovitz, David J.


Book ID
111650218
Publisher
The American Physical Society
Year
2010
Tongue
English
Weight
358 KB
Volume
81
Category
Article
ISSN
1098-0121

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## Abstract We calculate the mechanical and electron‐transport properties of graphene nanoribbons (GNRs) under uniaxial tensile strain with first‐principles density functional theory. Our calculations reveal that armchair‐ and zigzag‐shaped edges decrease and increase the tensile strength of GNR, r