BAND STRUCTURE CALCULATIONS OF GRAPHENE POLYTYPES

E.A. Belenkov, A.E. Kochengin

DOI: 10.26456/pcascnn/2014.6.047

Original article

Abstract: In this paper optimized structure of graphene layers L₆, L₃₋₁₂, L₄₋₈, L₄₋₆₋₁₂ and their band structure were calculated geometrically and by DFT.

Keywords: graphene, polytypism, band structure, modeling

• E.A. Belenkov
• A.E. Kochengin

Reference:

Belenkov E.A., Kochengin A.E. Raschet zonnoj struktury polimorfnykh raznovidnostej grafena [BAND STRUCTURE CALCULATIONS OF GRAPHENE POLYTYPES], Fiziko-khimicheskie aspekty izucheniya klasterov, nanostruktur i nanomaterialov [Physical and chemical aspects of the study of clusters, nanostructures and nanomaterials], 2014, issue 6, pp. 47-52. DOI: 10.26456/pcascnn/2014.6.047. ⎘

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