Origin of enhanced visible light driven water splitting by (Rh, Sb)-SrTiO3.

Abstract

A systematic calculation, using hybrid density functional theory, has been carried out to investigate the origin of the enhancement of photo-conversion efficiency of Rh-doped SrTiO3 with codoping of Sb. In the case of Rh-doped SrTiO3, partially unoccupied states are introduced above the valence band, thus lowering the hole oxidation at the valence band (VB… (More)
DOI: 10.1039/c5cp01374g

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