First-principles study of stability and electronic properties of single-element 2D materials

First-principles study of stability and electronic properties of single-element 2D materials

We have estimated stability of single-element 2D materials (C2, N2, Si2, P2, Ge2, As2, Sn2, Sb2, Pb2, and Bi2) by ab initio calculations. The calculations of structural and mechanical properties of 2D materials were performed using the VASP software package. The results of calculations of stiffness...

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Bibliographic Details
Main Author: D. C. Hvazdouski
Format: Article
Language:Russian
Published: Educational institution «Belarusian State University of Informatics and Radioelectronics» 2022-01-01
Series:Doklady Belorusskogo gosudarstvennogo universiteta informatiki i radioèlektroniki
Subjects:
2d material
ab initio
elastic constants
phonon dispersion
band structure
Online Access:https://doklady.bsuir.by/jour/article/view/3252
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