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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 |
License | |
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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