Barium tantalum oxynitride (BaTaO2N), as a member of an emerging class of perovskite
oxynitrides, is regarded as a promising inorganic material for solar water splitting because of …

SrTiO 3 based materials have been gaining attention recently in the field of photocatalysis
due to their tunable electronic structure. Herein, we employ a facile one pot solvothermal …

Cluster expansion (CE) provides a general framework for first-principles-based theoretical
modeling of multicomponent materials with configurational disorder, which has achieved …

A new ferroelectric perovskite oxynitride is proposed and demonstrated for photocatalytic
applications using a systematic first-principles study. Ruddlesden–Popper (RP) …

Materials exhibiting outstanding ion transport properties have been investigated for
extensive applications, and there has been an increasing demand for the rational design of …

Perovskite-type oxynitrides have attracted a lot of research interest as emerging functional
materials with promising wide applications. The ordering of O/N anions in perovskite …

Partial anion substitution in transition metal oxides provides rich opportunities to control and
tune physical and chemical properties, for example, combining the merits of oxides and …

Nitrogen/fluorine codoping of rutile TiO2 was recently reported to be effective for introducing
visible-light absorption, and the resultant TiO2: N, F worked efficiently as an O2 evolution …

BaTaO2N is appraised to be one of the few promising 600 nm-class photocatalysts for solar
water splitting. However, the presence of structural defects and low charge separation limits …

The counter electrode (CE) is an essential component in dye-sensitized solar cells (DSSCs)
to transfer electrons and catalyze triiodide reduction. In this research, efficient and cost …