塔菲尔方程
析氧
过电位
催化作用
材料科学
电化学
钴
密度泛函理论
工作(物理)
氧化还原
氧气
化学工程
分解水
化学
热力学
物理化学
计算化学
电极
冶金
有机化学
工程类
物理
光催化
作者
Jinsong Wang,Jia Liu,Bao Zhang,Houzhao Wan,Zhishan Li,Xiao Ji,Kaiqin Xu,Chi Chen,Dace Zha,Miao Liu,Jiang Jian-jun
出处
期刊:Nano Energy
[Elsevier]
日期:2017-12-01
卷期号:42: 98-105
被引量:97
标识
DOI:10.1016/j.nanoen.2017.10.044
摘要
Developing effective ways to promote the sluggish oxygen evolution reaction (OER) still remains a great challenge due to the interdependence multiple steps procedure. Herein, we design a two action sites strategy to break interdependence restriction to reduce the calculative overpotential. Density functional theory demonstrated that the introduced oxygen vacancies could accelerate the oxidation of H2O by induced an extra reaction step, corresponding deprotonation of H2O* decomposed into two separated reaction steps: H2O* ↔ (HO + H)* and (HO + H)*↔ HO* + H+ + e-. Meanwhile, experimental observations confirm that two action sites promote the Vo-CoOOH OER performance including a lower onset potential, a lower Tafel slope and an incremental Turnover frequency (TOF) from 0.01 to 0.04 s−1. Through this work, a viable design principle for, but not limited to, CoOOH OER catalyst is proposed: injected hole can activate the synergistic catalytic effect of two actions sites to accelerate the water oxidation.
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