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arxiv: 1305.5137 · v1 · pith:AXGPGR4Xnew · submitted 2013-05-22 · ❄️ cond-mat.mtrl-sci · cond-mat.mes-hall

Edge states of zigzag graphene nanoribbons with B and N doping at edge atoms

classification ❄️ cond-mat.mtrl-sci cond-mat.mes-hall
keywords atomsedgezigzagnanoribbonsstatesgraphenebandsflat
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Using a tight binding model, we theoretically study the electronic properties of zigzag boron-carbon-nitride (BCN) nanoribbons where the outermost C atoms of zigzag graphene nanoribbons are replaced with B and N atoms. We show that the flat bands and edge states appear at the Fermi level when the number of B and N atoms are equal except the case of six times supercell. To investigate the origin of the edge states in BCN nanoribbons, we consider the semi-infinite graphene sheet with zigzag edge where outermost C atoms are replaced with B and N atoms. We analytically demonstrate the presence of edge states at the zigzag edges and flat bands using a transfer matrix method.

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