催化作用
选择性
化学
离解(化学)
产量(工程)
密度泛函理论
环糊精
反应性(心理学)
吸附
组合化学
电解质
化学工程
材料科学
物理化学
有机化学
计算化学
电极
病理
冶金
替代医学
医学
工程类
作者
Defeng Qi,Jie Xu,Yitong Zhou,Hao Zhang,Jianqiao Shi,Kun He,Yifei Yuan,Jun Luo,Shun Wang,Yong Wang
标识
DOI:10.1002/anie.202307355
摘要
Co-based material catalysts have shown attractive application prospects in the 2 e- oxygen reduction reaction (ORR). However, for the industrial synthesis of H2 O2 , there is still lack of Co-based catalysts with high production yield rate. Here, novel cyclodextrin-supported Co(OH)2 cluster catalysts were prepared via a mild and facile method. The catalyst exhibited remarkable H2 O2 selectivity (94.2 % ~ 98.2 %), good stability (99 % activity retention after 35 h), and ultra-high H2 O2 production yield rate (5.58 mol gcatalyst-1 h-1 in the H-type electrolytic cell), demonstrating its promising industrial application potential. Density functional theory (DFT) reveals that the cyclodextrin-mediated Co(OH)2 electronic structure optimizes the adsorption of OOH* intermediates and significantly enhances the activation energy barrier for dissociation, leading to the high reactivity and selectivity for the 2 e- ORR. This work offers a valuable and practical strategy to design Co-based electrocatalysts for H2 O2 production.
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