Computational study of physical properties of double perovskite RbBa2Zr3O10 material for photocatalytic applications: DFT insights

Materials Science in Semiconductor Processing, Journal Year: 2025, Volume and Issue: 188, P. 109255 - 109255

Published: Jan. 5, 2025

Language: Английский

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A first principles insight of non-toxic lead-free inorganic halides KInX3 (X= F, Cl, Br and I) for visible-light photocatalytic water splitting application

Materials Research Bulletin, Journal Year: 2025, Volume and Issue: unknown, P. 113328 - 113328

Published: Jan. 1, 2025

Language: Английский

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Unlocking the Narrow Bandgap Investigations of Perovskite JHgF3 (J = Li, Na, and Rb) Materials: Computational Predictions for Optoelectronic Devices

Journal of Physics and Chemistry of Solids, Journal Year: 2025, Volume and Issue: unknown, P. 112729 - 112729

Published: March 1, 2025

Language: Английский

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First-principles study of triaxial strain effect on structural, mechanical, electronic, optical, and photocatalytic properties of K2SeBr6 for solar hydrogen production

Chemical Physics, Journal Year: 2025, Volume and Issue: unknown, P. 112739 - 112739

Published: April 1, 2025

Language: Английский

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Study of physical properties of novel perovskite FrJCl3 (J = Be, Mg) materials: DFT predictions for photovoltaic applications

Journal of Materials Science Materials in Electronics, Journal Year: 2025, Volume and Issue: 36(11)

Published: April 1, 2025

Language: Английский

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