电催化剂
过电位
氢氧化钴
析氧
钴
电子转移
密度泛函理论
金属有机骨架
金属
无机化学
化学
氢氧化物
材料科学
化学工程
电化学
光化学
电极
有机化学
吸附
计算化学
工程类
物理化学
作者
Na Yao,Zhengyin Fan,Ran Meng,Hongnan Jia,Wei Luo
标识
DOI:10.1016/j.cej.2020.127319
摘要
Although metal–organic frameworks (MOFs) with coordinatively unsaturated metal centers have been regarded as promising electrocatalysts towards oxygen evolution reaction (OER), few reports focus on MOFs with inactive coordinative-saturated metal centers. Herein, we report a universal strategy to generate a layer of Co(OH)2 coating on the surface of Co-MOFs (Co(OH)2/Co-MOF) through an in situ cathodic electro- transformation approach. Experimental analysis and density functional theory (DFT) calculations reveal that electrons transfer from Co(OH)2 to Co-MOF could synergistically tailor the adsorption free energy of oxygenic intermediates in the OER pathways, which together with the unique structure of Co-MOF, contribute to the outstanding OER performance and long-term stability, with overpotential of 196 mV to achieve the current density of 10 mA cm−2.
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