Atomically thin sheets (eg, graphene and monolayer molybdenum disulfide) are ideal optical
and reaction platforms. They provide opportunities for deciphering some important and often …

Polymeric carbon nitride (C3N4) has attracted great attention in photocatalysis due to its low-
cost, visible-light response, and environment-friendly merits. However, the catalytic …

Overall water splitting (OWS) using particulate photocatalysts is a promising and
straightforward route for producing sustainable and clean hydrogen. Strontium titanate …

The use of semiconductor photocatalysis for hydrogen production is an ideal approach for
achieving solar energy and conversion. In this work, we systematically examine the …

With the swift progress of metal halide perovskite solar cells (PSCs), new Pb-free
perovskites represented by Cs 3 Sb 2 I 9 have demonstrated broader application prospects …

High-entropy alloys and ceramics containing at least five principal elements have recently
received high attention for various mechanical and functional applications. The application …

Vertical van der Waals (vdW) heterostructures have shown potential for gas sensing owing
to their remarkable sensitivity. However, the optimization process for achieving the best gas …

Utilising photocatalytic water splitting to produce green hydrogen is the key to reducing the
carbon footprint of this crucial chemical feedstock. In this study, density functional theory …

In recent years, several atomically thin two-dimensional (2D) materials have been reported
with remarkable properties that prospect them as potential structures for nanotechnological …

We report the excitonic effects in the 1T and 1O T phases of PdS 2, PdSe 2, and PdSSe
monolayers. Using fully relativistic norm-conserving non-local PBE pseudopotentials and …