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Physical characteristics of CdZrO3 perovskite at different pressure for optoelectronic application
Physics Department, KFUEIT, Rahim Yar Khan, Punjab, Pakistan.
Physics Department, KFUEIT, Rahim Yar Khan, Punjab, Pakistan.
Physics Department, KFUEIT, Rahim Yar Khan, Punjab, Pakistan.
Luleå University of Technology, Department of Engineering Sciences and Mathematics, Material Science.ORCID iD: 0000-0001-6659-9771
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2020 (English)In: Journal of Materials Research and Technology, ISSN 2238-7854, E-ISSN 2214-0697, Vol. 9, no 5, p. 9965-9971Article in journal (Refereed) Published
Abstract [en]

A comprehensive investigation of the physical characteristics of any material provides beneficial information regarding its application viewpoint in different industries. Herein, we report the tunable mechanical and optoelectronic properties of cubic CdZrO3 under variable pressure up to 80 GPa using density functional theory (DFT). The pressure-induced band gap engineering reveals a fantastic fact of transformation of the indirect to direct band gap with increasing pressure. The dielectric response disclosed that optical parameters dragged towards higher energy with an increase of pressure, which unveiled the potential of CdZrO3 for optoelectronic applications. Effective change in optoelectronic is attributed to indirect to direct band gap transition. This study provides a gateway to how the optoelectronic properties of cubic CdZrO3 could be tuned by employing external pressure.

Place, publisher, year, edition, pages
Elsevier, 2020. Vol. 9, no 5, p. 9965-9971
Keywords [en]
Density functional theory, Band gap engineering, Mechanical properties, Optoelectronic properties
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Applied Physics
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URN: urn:nbn:se:ltu:diva-80542DOI: 10.1016/j.jmrt.2020.06.086ISI: 000579367500047Scopus ID: 2-s2.0-85092054927OAI: oai:DiVA.org:ltu-80542DiVA, id: diva2:1460709
Note

Godkänd;2020;Nivå 0;2020-08-25 (alebob)

Available from: 2020-08-25 Created: 2020-08-25 Last updated: 2024-09-02Bibliographically approved

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Sajjad, Muhammad

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