Effect of rhodium doping for photocatalytic activity of barium titanate

Effect of rhodium doping for photocatalytic activity of barium titanate

By means of DFT oxygen evolution reaction on Rh-doped BaTiO3 (001) surface has been modeled. Gibbs free energies for each step of the reaction as well as the values of overpotential have been calculated, taking into account the solvation effect. The position of Rh-induces defect energy levels have b...

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Bibliographic Details
Main Authors:	G.A. Kaptagay, B.M. Satanova, A.U. Abuova, M. Konuhova, Zh.Ye. Zakiyeva, U. Zh Tolegen, N.O. Koilyk, F.U. Abuova
Format:	Article
Language:	English
Published:	Elsevier 2025-02-01
Series:	Optical Materials: X
Subjects:	Electrocatalysis Photocatalysis Energy storage and conversion Electrode materials Water splitting
Online Access:	http://www.sciencedirect.com/science/article/pii/S2590147824000949
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