Discovery of hydrogen spillover-based binary electrocatalysts for hydrogen evolution: from theory to experiment

• Main Authors: Tan, Yuan, Zhu, Yucheng, Cao, Xaofei, Liu, Yuhao, Li, Jiayuan, Chen, Zhong, Hu, Jun
• Other Authors: School of Materials Science and Engineering
• Format: Article
• Language: English
• Published: 2023
• Subjects: Engineering::Chemical engineering; Hydrogen Spillover; Hydrogen Evolution Reaction
• Online Access: https://hdl.handle.net/10356/164313
• Institution: Nanyang Technological University

Hydrogen spillover-based binary (HSBB) catalysts have attracted more and more attention in recent years because of their unique reaction mechanism, different from traditional single-component catalysts. In this paper, using density functional theory for the screening of materials, we find 11 candida...