First-principles study on the electronic and optical properties of Bi2WO6-Reference-Cited by-同舟云学术

First-principles study on the electronic and optical properties of Bi2WO6

Published:2021 Issue:51 Volume:11 Page:32330-32338
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Ahmad Haseeb¹,Rauf Ali²^ORCID,Ahmad Afaq³,Ulhaq Ata¹,Muhammad Shoaib²

Affiliation:

1. Department of Physics, Lahore University of Management Sciences, Lahore, Pakistan

2. Department of Chemistry and Chemical Engineering, Lahore University of Management Sciences, Lahore, Pakistan

3. Centre of Excellence in Solid State Physics, University of the Punjab, Quaid-i-Azam Campus, Lahore, Pakistan

Abstract

The nature of the band gap obtained from SOC and QP corrections changes to indirect. The semi-core states of Bi have been proved to be crucial in the GW calculations. Optical absorption from BSE, including SOC best matches the experimental data.

Funder

Lahore University of Management Sciences

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2021/RA/D1RA03784F

Reference67 articles.

1. Electrochemical Photolysis of Water at a Semiconductor Electrode

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4. DFT study of various tungstates for photocatalytic water splitting

5. Mediator- and co-catalyst-free direct Z-scheme composites of Bi2WO6–Cu3P for solar-water splitting

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