Defect-Induced Modulation of a 2D ZnO/Graphene Heterostructure: Exploring Structural and Electronic Transformations

Defect-Induced Modulation of a 2D ZnO/Graphene Heterostructure: Exploring Structural and Electronic Transformations

This paper presents a theoretical study on the effects of selected defects (oxygen vacancies and substitutional Fe<sub>Zn</sub> atoms) on the structural and electronic properties of a 2D ZnO/graphene heterostructure. Spin-polarized Hubbard- and dispersion-corrected density functional the...

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Bibliographic Details
Main Author: Ivan Shtepliuk
Format: Article
Language:English
Published: MDPI AG 2023-06-01
Series:Applied Sciences
Subjects:
2D ZnO
van der Waals heterostructure
graphene
spin-polarized density functional theory
band structure
defect engineering
Online Access:https://www.mdpi.com/2076-3417/13/12/7243

Internet

https://www.mdpi.com/2076-3417/13/12/7243

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