Influence of Vacancy Defects on the Interfacial Structural and Optoelectronic Properties of ZnO/ZnS Heterostructures for Photocatalysis

Influence of Vacancy Defects on the Interfacial Structural and Optoelectronic Properties of ZnO/ZnS Heterostructures for Photocatalysis

Hybrid density functional theory has been employed to study the influence of interfacial oxygen (O), sulfur (S) and zinc (Zn) vacancies on the optoelectronic properties of ZnO/ZnS heterostructure. The results show that the O, S, and Zn vacancies can decrease cell volume of the ZnO/ZnS heterostructur...

Full description

Bibliographic Details
Main Authors: Sajjad Hussain, Lingju Guo, Tao He
Format: Article
Language:English
Published: MDPI AG 2023-08-01
Series:Catalysts
Subjects:
ZnO/ZnS heterostructure
interfacial vacancy
band alignment
interfacial charge behavior
optoelectronic property
hybrid DFT calculations
Online Access:https://www.mdpi.com/2073-4344/13/8/1199

Internet

https://www.mdpi.com/2073-4344/13/8/1199

Similar Items