三元运算
双功能
催化作用
氧还原反应
密度泛函理论
化学
析氧
Atom(片上系统)
氧气
钴
吸附
化学工程
组合化学
无机化学
物理化学
计算化学
电极
有机化学
电化学
计算机科学
嵌入式系统
程序设计语言
工程类
作者
Ruisong Li,Chengshan Gu,Peng Rao,Peilin Deng,Daoxiong Wu,Junming Luo,Jing Li,Zhengpei Miao,Chongwei Zheng,Chong Shen,Xinlong Tian
标识
DOI:10.1016/j.cej.2023.143641
摘要
Synergistic effects have been demonstrated for binary single-atom catalysts (SACs), while it is still challenging to investigate the activity and performance of ternary SACs due to the lack of robust method to synthesize these materials. Herein, we provide a general approach for the preparation of ternary SACs, and the features of single atoms highly dispersed on the support have been identified and verified. As an illustration, trace platinum decorated iron-cobalt ternary single atom catalysts (PtFeCo/NC) possess an obviously enhanced bifunctional activity of oxygen reduction reaction (ORR) and oxygen evolution reaction (OER), as well as high stability. The density functional theory calculations reveal that the synergistic effects induced by the introduction of Pt enable modulating the adsorption strength of reaction intermediates both on the Fe-N4 and Co-N4 sites, thus enhancing the ORR and OER activity, respectively. In addition, the PtFeCo/NC-based Zn-air battery delivers a higher power density than that of commercial Pt/C-RuO2, and can be steadily operated over 188 h.
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