Two-dimensional carbon structures study within density functional theory
In this paper by means of ab initio, from the first principles, modeling, electronic properties of a monolayer and bilayer of graphene are studied. Calculations of electron density and band structure of these substances are carried out. For verification of obtained results, calculated values are com...
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Format: | Tagungsbericht |
Sprache: | eng |
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Online-Zugang: | Volltext |
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Zusammenfassung: | In this paper by means of ab initio, from the first principles, modeling, electronic properties of a monolayer and bilayer of graphene are studied. Calculations of electron density and band structure of these substances are carried out. For verification of obtained results, calculated values are compared with known experimental results from angle-resolved photoemission spectroscopy (ARPES). |
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ISSN: | 0094-243X 1551-7616 |
DOI: | 10.1063/1.5012650 |