揭示了钌氧中Cr掺杂物在高效酸水氧化中的作用

IF 3.3 3区 化学 Q2 CHEMISTRY, INORGANIC & NUCLEAR Dalton Transactions Pub Date : 2025-01-13 DOI:10.1039/D4DT03131H
Hui Liu, Maolin Li, Zhizhao Zhang, Ying Li, Qiuyan Hao, Limin Liang and Wen Zhang
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引用次数: 0

摘要

设计高效耐用的酸性析氧反应(OER)电催化剂是实现高效产氢的关键。本文报道了一种在酸性电解质中表现出良好OER活性的cr掺杂RuO2 (Ru0.9Cr0.1O2)催化剂。Cr的掺杂增加了Ru的价态,提高了催化剂的活性,在235 mV下可以达到10 mA cm−2的电流密度,优于未修饰的RuO2的299 mV。催化剂的Tafel斜率为63.9 mV dec−1,远优于未改性的RuO2的91.1 mV dec−1。此外,该催化剂能够在0.5 M H2SO4中保持稳定的催化性能长达30小时。密度泛函理论(DFT)计算也表明,Cr掺杂优化了中间体在Ru位点的吸附,显著提高了Ru位点的催化活性。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

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Uncovering the role of the Cr dopant in RuO2 in highly efficient acid water oxidation†

The design of acidic oxygen evolution reaction (OER) electrocatalysts with high activity and durability is the key to achieving efficient hydrogen production. Herein, we report a Cr-doped RuO2 (Ru0.9Cr0.1O2) catalyst that exhibits good OER activity in acidic electrolytes. The doping of Cr increases the valence state of Ru, which enhances the activity of the catalyst, and a current density of 10 mA cm−2 can be achieved at only 235 mV, which is superior to that of unmodified RuO2 of 299 mV. The Tafel slope of the catalyst was 63.9 mV dec−1, which is much better than that of unmodified RuO2 at 91.1 mV dec−1. In addition, this catalyst was able to maintain stable catalytic performance in 0.5 M H2SO4 for up to 30 hours. Density functional theory (DFT) calculations also showed that Cr doping optimized the adsorption of intermediates at Ru sites and significantly increased the catalytic activity of the Ru sites.

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来源期刊
Dalton Transactions
Dalton Transactions 化学-无机化学与核化学
CiteScore
6.60
自引率
7.50%
发文量
1832
审稿时长
1.5 months
期刊介绍: Dalton Transactions is a journal for all areas of inorganic chemistry, which encompasses the organometallic, bioinorganic and materials chemistry of the elements, with applications including synthesis, catalysis, energy conversion/storage, electrical devices and medicine. Dalton Transactions welcomes high-quality, original submissions in all of these areas and more, where the advancement of knowledge in inorganic chemistry is significant.
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