异质结
电催化剂
电解
电化学
阳极
吸附
材料科学
密度泛函理论
化学工程
法拉第效率
选择性
无机化学
化学
催化作用
电极
光电子学
物理化学
计算化学
有机化学
电解质
工程类
作者
Honglei Wang,Yumeng Zhou,Shengyang Tao
标识
DOI:10.1016/j.apcatb.2022.121588
摘要
The interfacial electron modulation of electrocatalyst is an effective strategy to realize the oxidation of organic chemicals. Here, a heterojunction (CoP-CoOOH) is prepared via a modulating electron density between interfaces for 5-hydroxymethylfurfural (HMF) oxidation to 2,5-furanedioic acid (FDCA) in high concentration. Density Functional Theory (DFT) shows that heterojunction increased efficient charged active centers, enhanced the adsorption of the reactant on the surface of electrocatalyst, and improved the HMF oxidation reaction (HMFOR) activity. The electrolyzer using CoP-CoOOH as cathodic evolution H2 and anodic HMFOR requires only voltage of 1.42 V. Additionally, the diffusion limitation of the reaction is overcome via coupling with the flow reactor, which further improved the HMFOR efficiency. Although the HMF concentration is 150 mM, the Faraday efficiency of HMF and the selectivity of FDCA in the flow reactor are 98.2 % and 99.4 %, respectively.
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