A new highly stable multifunctional two-dimensional Si<sub>2</sub>BN monolayer quantum material with a direct bandgap predicted by density functional theory-Reference-Cited by-同舟云学术

A new highly stable multifunctional two-dimensional Si₂BN monolayer quantum material with a direct bandgap predicted by density functional theory

Published:2024 Issue:30 Volume:26 Page:20610-20618
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Djamel Bezzerga¹,Chelil Naouel²,Mohammed Sahnoun²,Gusarov Sergey³,Chang Gap Soo⁴,Naseri Mosayeb⁵^ORCID

Affiliation:

1. Department of Physics, University of Relizane, Algeria

2. Laboratoire de Physique Quantique de la Matière et Modèlisation Mathèmatique (LPQ3M), University of Mascara, Algeria

3. Digital Technologies Research Centre, National Research Council Canada, 1200 Montreal Road, Ottawa, Ontario K1A0R6, Canada

4. Department of Physics and Engineering Physics, University of Saskatchewan, Saskatoon, SK S7N5E2, Canada

5. Department of Chemistry, Department of Physics and Astronomy, CMS – Center for Molecular Simulation, IQST – Institute for Quantum Science and Technology, Quantum Alberta, University of Calgary, 2500 University Drive NW, Calgary, Alberta, Canada, T2N 1N4

Abstract

A new, highly stable two-dimensional quantum material, termed 2D δ-Si2BN monolayer, is predicted using density functional theory. This semiconductor material features a moderate bandgap and shows great promise for use in solar cell applications.

Funder

National Research Council Canada

Natural Sciences and Engineering Research Council of Canada

Compute Canada

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2024/CP/D4CP01445F

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