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Title Nanotube Connections in Bilayer Graphene with Elongated Holes
Authors Chernozatonskii, L.A.
Demin, V.A.
ORCID
Keywords Bigraphene
Molecular Mechanics
DFT
Carbon Nanostructure
Type Conference Papers
Date of Issue 2013
URI http://essuir.sumdu.edu.ua/handle/123456789/35460
Publisher Sumy State University
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Citation Chernozatonskii, L.A. Nanotube Connections in Bilayer Graphene with Elongated Holes [Текст] / L.A. Chernozatonskii, V.A. Demin // Nanomaterials: Applications & Properties (NAP-2013): 2-nd International conference, Alushta, the Crimea, September 17-22, 2012 / Edited by: A. Pogrebnjak. - Sumy: Sumy State University, 2013. - V.2, No3. - 03NCNN32
Abstract Structures, stability and electronic properties of AA-stacking bigraphene with holes are studied using molecular mechanic and DFT method calculations. It has been shown the zig-zag edges of considered elon-gated holes lead to armchair sp2-nanotube-type connection between these two edges forming all sp2-structure. We consider similar periodic structures with (n,n) nanotubes formed among elongated holes and connected with bigraphene fragments, which edges are also closed edges. The stability and electronic prop-erties of these structures are investigated. Band structures of considered materials have energy gaps 0.20-0.27 eV in the direction of tube axes through jumpers on the connections, and Dirac-like point views in the opposite direction. When you are citing the document, use the following link http://essuir.sumdu.edu.ua/handle/123456789/35460
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