Al <sup>3+</sup> ‐Dependent Anisotropic Facet Tailoring on SrTiO <sub>3</sub> Single Crystal for Photocatalytic Overall Water Splitting

Y Yang Zhang Z Zhi‐Hao Wang (Beijing Computational Science Research Center Beijing 100193 China) W Wenbo Li P Peng Cheng Ding (Key Laboratory for Ultrafine Materials of Ministry of Education, Shanghai Engineering Research Center of Hierarchical Nanomaterials, School of Materials Science and Engineering East China University of Science and Technology 130 Meilong Road Shanghai 200237 China) M Meng Min Wang (Key Laboratory for Ultrafine Materials of Ministry of Education, School of Materials Science and Engineering East China University of Science and Technology 130 Meilong Road Shanghai 200237 China) Y Yu Yang Tang (Key Laboratory for Ultrafine Materials of Ministry of Education, School of Materials Science and Engineering East China University of Science and Technology 130 Meilong Road Shanghai 200237 China) H Hao Yang Lin (Key Laboratory for Ultrafine Materials of Ministry of Education, Shanghai Engineering Research Center of Hierarchical Nanomaterials, School of Materials Science and Engineering) Y Yu Peng M Meng Yi Wang (Key Laboratory for Ultrafine Materials of Ministry of Education, School of Materials Science and Engineering East China University of Science and Technology 130 Meilong Road Shanghai 200237 China) Z Zhaoke Zheng (State Key Laboratory of Crystal Materials) S Shuang Yang (Micro−Nano Engineering Sciences Research Center, School of Mechanical Engineering) S Sheng Dai X Xie Zhang (School of Materials Science and Engineering) P Peng Fei Liu (Key Laboratory for Ultrafine Materials of Ministry of Education, Shanghai Engineering Research Center of Hierarchical Nanomaterials, School of Materials Science and Engineering, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China) H Hua Gui Yang (Key Laboratory for Ultrafine Materials of Ministry of Education, Shanghai Engineering Research Center of Hierarchical Nanomaterials, School of Materials Science and Engineering, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China)

Abstract

Abstract Controllable fabrication of single‐crystal metal oxide is of paramount importance for advanced photo(electro)catalytic applications, but achieving nonequilibrium crystal shapes with tailored facets through molten salt synthesis still remains a challenge. Herein, we systematically explored the effect of Al 3+ concentration in tailoring crystal facets of SrTiO 3 single crystals and developed a one‐step molten salt strategy for engineering anisotropic structures by using miscible AlCl 3 as Al 3+ additive. By progressively increasing Al 3+ concentration, a series of high‐quality SrTiO 3 single crystals exposing {100}, {111}, and {110} facets were sequentially synthesized. Theoretical calculations reveal an Al‐doping stabilized {111} surface reconstruction and provide further atomistic insights into the surface structural evolution with Wulff constructions as Al 3+ concentration increases. Experimental results demonstrate that the anisotropic facets dominate the efficient charge separation for the enhanced photocatalytic overall water splitting activity. Consequently, SrTiO 3 single crystals enclosed by well‐defined {100} and {111} facets exhibit a remarkable hydrogen evolution rate of 2621.85 µmol·h −1 and an apparent quantum yield value of 50.5% at 350 nm for stoichiometric overall water splitting. This work offers a molten‐salt synthetic strategy and valuable insight for preparing facet‐controlled single‐crystal semiconductors.

Article Details

Volume / Issue Vol. 64, Issue 30
Published July 21, 2025
ISSN 1433-7851
Publisher Wiley

Journal Info

Angewandte Chemie International Edition

Wiley

ISSN: 1433-7851 Physical Sciences

Authors (15)

Y

Yang Zhang

Z

Zhi‐Hao Wang

Beijing Computational Science Research Center Beijing 100193 China

W

Wenbo Li

P

Peng Cheng Ding

Key Laboratory for Ultrafine Materials of Ministry of Education, Shanghai Engineering Research Center of Hierarchical Nanomaterials, School of Materials Science and Engineering East China University of Science and Technology 130 Meilong Road Shanghai 200237 China

M

Meng Min Wang

Key Laboratory for Ultrafine Materials of Ministry of Education, School of Materials Science and Engineering East China University of Science and Technology 130 Meilong Road Shanghai 200237 China

Y

Yu Yang Tang

Key Laboratory for Ultrafine Materials of Ministry of Education, School of Materials Science and Engineering East China University of Science and Technology 130 Meilong Road Shanghai 200237 China

H

Hao Yang Lin

Key Laboratory for Ultrafine Materials of Ministry of Education, Shanghai Engineering Research Center of Hierarchical Nanomaterials, School of Materials Science and Engineering

Y

Yu Peng

M

Meng Yi Wang

Key Laboratory for Ultrafine Materials of Ministry of Education, School of Materials Science and Engineering East China University of Science and Technology 130 Meilong Road Shanghai 200237 China

Z

Zhaoke Zheng

State Key Laboratory of Crystal Materials

S

Shuang Yang

Micro−Nano Engineering Sciences Research Center, School of Mechanical Engineering

S

Sheng Dai

X

Xie Zhang

School of Materials Science and Engineering

P

Peng Fei Liu

Key Laboratory for Ultrafine Materials of Ministry of Education, Shanghai Engineering Research Center of Hierarchical Nanomaterials, School of Materials Science and Engineering, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China

H

Hua Gui Yang

Key Laboratory for Ultrafine Materials of Ministry of Education, Shanghai Engineering Research Center of Hierarchical Nanomaterials, School of Materials Science and Engineering, East China University of Science and Technology, 130 Meilong Road, Shanghai 200237, China