Metallic behavior and enhanced adsorption energy of graphene on BN layer induced by Cu(111) substrate View Full Text


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Article Info

DATE

2014-03

AUTHORS

Arqum Hashmi, Jisang Hong

ABSTRACT

We have investigated the adsorption properties and the electronic structure of graphene/BN and graphene/BN/Cu(111) systems by using van der Waals density functional theory. The ground-state adsorption site of graphene on BN/Cu(111) is found to be the same as that of graphene/BN. The Cu(111) substrate did not induce a significant change in the geometrical feature of graphene/BN. However, the adsorption energy of graphene on BN/Cu(111) is observed to be enhanced due to the Cu(111) substrate. In addition, we have found that the graphene layer displays a weak metallic character in graphene/BN/Cu(111) whereas an energy band gap is observed in the graphene in the graphene/BN bilayer system. Therefore, we have found that the metallic Cu(111) substrate affects the electronic structure and adsorption properties of graphene on BN/Cu(111), although it has no significant effect on the geometrical features More... »

PAGES

900-903

Identifiers

URI

http://scigraph.springernature.com/pub.10.3938/jkps.64.900

DOI

http://dx.doi.org/10.3938/jkps.64.900

DIMENSIONS

https://app.dimensions.ai/details/publication/pub.1020908469


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