Defect engineering in transition‐metal (Fe, Co, and Ni)‐based electrocatalysts for water splitting

Abstract Electrocatalytic water splitting seems to be an efficient strategy to deal with increasingly serious environmental problems and energy crises but still suffers from the lack of stable and efficient electrocatalysts. Designing practical electrocatalysts by introducing defect engineering, such as hybrid structure, surface vacancies, functional modification, and structural distortions, is proven to be a dependable solution for fabricating electrocatalysts with high catalytic activities, robust stability, and good practicability. This review is an overview of some relevant reports about the effects of defect engineering on the electrocatalytic water splitting performance of electrocatalysts. In detail, the types of defects, the preparation and characterization methods, and catalytic performances of electrocatalysts are presented, emphasizing the effects of the introduced defects on the electronic structures of electrocatalysts and the optimization of the intermediates' adsorption energy throughout the review. Finally, the existing challenges and personal perspectives of possible strategies for enhancing the catalytic performances of electrocatalysts are proposed. An in‐depth understanding of the effects of defect engineering on the catalytic performance of electrocatalysts will light the way to design high‐efficiency electrocatalysts for water splitting and other possible applications.