TiO2-based photocatalysts from type-II to S-scheme heterojunction and their applications

Journal of Colloid and Interface Science, Год журнала: 2024, Номер 675, С. 150 - 191

Опубликована: Июнь 27, 2024

Язык: Английский

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Innovative fabrication of highly efficient CeO2 ceramic nanomaterials for enhanced photocatalytic degradation of toxic contaminants under sunlight

Ceramics International, Год журнала: 2024, Номер unknown

Опубликована: Сен. 1, 2024

Язык: Английский

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Enhanced photocatalytic degradation of tetracycline by Mn,S co-doped TiO2 under visible-light irradiation

Journal of Photochemistry and Photobiology A Chemistry, Год журнала: 2025, Номер unknown, С. 116423 - 116423

Опубликована: Апрель 1, 2025

Язык: Английский

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First principles investigation for the hydrogen storage properties of novel lithium-based XLiH3 (X=K, Rb) perovskite-type hydrides for advance hydrogen storage system

International Journal of Hydrogen Energy, Год журнала: 2024, Номер 87, С. 566 - 573

Опубликована: Сен. 10, 2024

Язык: Английский

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Applications of machine learning in surfaces and interfaces

Chemical Physics Reviews, Год журнала: 2025, Номер 6(1)

Опубликована: Март 1, 2025

Surfaces and interfaces play key roles in chemical material science. Understanding physical processes at complex surfaces is a challenging task. Machine learning provides powerful tool to help analyze accelerate simulations. This comprehensive review affords an overview of the applications machine study systems materials. We categorize into following broad categories: solid–solid interface, solid–liquid liquid–liquid surface solid, liquid, three-phase interfaces. High-throughput screening, combined first-principles calculations, force field accelerated molecular dynamics simulations are used rational design such as all-solid-state batteries, solar cells, heterogeneous catalysis. detailed information on for

Язык: Английский

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The influence of bandgap tunability on the physical features of Rb2LiSbX6 (X=Cl, Br) double perovskites in the context of green technologies

Physica B Condensed Matter, Год журнала: 2024, Номер 697, С. 416695 - 416695

Опубликована: Ноя. 7, 2024

Язык: Английский

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Optoelectronic and structural properties of bulk cubic perovskite RbTaO3 and surface (0 0 1) for optoelectronic and spintronics applications

Materials Chemistry and Physics, Год журнала: 2024, Номер 327, С. 129778 - 129778

Опубликована: Авг. 16, 2024

Язык: Английский

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The modulation of the electronic properties of MoSi2N4/CdS heterostructure by interlayer spacing, strain, and electric field: A first-principles investigations

Chinese Journal of Physics, Год журнала: 2025, Номер unknown

Опубликована: Фев. 1, 2025

Язык: Английский

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First-principles investigation of Sc and Ti-decorated hBN monolayers as adsorbents and gas sensors for SF6 decomposition products

Chemical Physics, Год журнала: 2025, Номер unknown, С. 112708 - 112708

Опубликована: Март 1, 2025

Язык: Английский

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First-Principles Insights into Interlayer Distance, Strain, and Electric Field-Modulated Electronic Properties of FeCl₃/WSi₂N₄ Heterostructures

The Journal of Physical Chemistry C, Год журнала: 2025, Номер unknown

Опубликована: Март 26, 2025

Язык: Английский

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