替代(逻辑)
氧气
Boosting(机器学习)
化学
5-羟甲基糠醛
析氧
有机化学
催化作用
电化学
计算机科学
物理化学
电极
机器学习
程序设计语言
作者
Liyan Wang,Zhaokun Wang,Liang Chu,Mu Yang,Ge Wang
标识
DOI:10.1016/j.electacta.2024.144362
摘要
The design of transition metal nitrides with excellent oxygen evolution reaction and 5-hydroxymethylfurfural oxidation reaction (HMFOR) is of great significance to achieve the goal of "carbon peaking and carbon neutrality". Herein, Fe-doped bimetallic nitride FexCo1-x)4N was prepared by a simple electron regulation strategy. The introduction of Fe changes the electronic structure of Co and optimizes the adsorption energies of *OH, reduces the potential barrier for the generation of *OOH as a potential-determining step and thus increases the intrinsic OER activity of Co4N. In addition, Fe substitution of some of the Co atoms gives (FexCo1-x)4N a higher electrochemical active surface area, which accelerates the electron transfer efficiency and improves the electrical conductivity. The overpotential for (FexCo1-x)4N-0.9 to reach a current density of 10 mA cm−2 in 1 M KOH is only 271 mV. When in 1 M KOH + 50 mM HMF condition, (FexCo1-x)4N requires only 1.37 V to reach a current density of 10 mA cm−2. This work provides practical guidance for developing bifunctional transition metal electrocatalysts with excellent OER and HMFOR activity.
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