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Atomic and electronic structures of divacancy in graphene nanoribbons

✍ Scribed by Jun Zhao; Hui Zeng; Jianwei Wei


Book ID
113849742
Publisher
Elsevier Science
Year
2012
Tongue
English
Weight
888 KB
Volume
407
Category
Article
ISSN
0921-4526

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## Abstract We perform __ab initio__ calculations for graphene nanoribbons (GNRs) using density‐functional theory (DFT) and generalized gradient approximation (GGA) functionals. We present results for the dependence of the band structures and energy gaps on the ribbon widths for armchair and zigzag