在氧化亚铜中原子分散的钪削弱了*CO吸附力,促进了二氧化碳向C2产物的电还原

IF 18.5 1区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY
Rongzhen Chen, Yuhang Jiang, Yihua Zhu, Ling Zhang, Yuhang Li, Chunzhong Li
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引用次数: 0

摘要

铜(Cu)是一种很有前景的金属,可用于电化学二氧化碳还原反应(eCO2RR),生成高附加值的 C2 产品。然而,作为 C─C 偶联生成 C2 产物的关键中间体,*CO 中间体很难在铜表面被适度吸附。稀土元素具有独特的电子结构,可有效调节周围原子的局部密度,但却很少有人对其进行研究。本文筛选了不同的稀土金属掺杂 Cu2O,并通过原位 ATR-SEIRAS 和 DFT 计算发现,原子分散的 Sc Cu2O 可以减弱 CO 在催化剂表面的吸附,降低 C─C 偶联步骤的能垒。因此,制备的 Sc0.09-Cu2O 催化剂改善了 eCO2RR 到 C2 产物的性能,在电流密度为 600 mA cm-2 时的远动效率为 71.9%。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Atomically Dispersed Scandium in Cuprous Oxide Weakens *CO Adsorption to Boost Carbon Dioxide Electroreduction Toward C2 Products

Atomically Dispersed Scandium in Cuprous Oxide Weakens *CO Adsorption to Boost Carbon Dioxide Electroreduction Toward C2 Products
Copper (Cu) is a promising metal for electrochemical CO2 reduction reaction (eCO2RR) to value-added C2 products. However, as the key intermediate for C─C coupling to form C2 products, *CO intermediate is difficult to adsorb on the Cu surface on a moderate level. Rare earth elements possess a distinctive electronic structure that effectively regulates the local density of surrounding atoms, yet has rarely been investigated. Herein, different rare earth metals are screened doping Cu2O and found that Sc atomically dispersed Cu2O can weaken the CO adsorption on the catalyst surface and lower the energy barrier of the C─C coupling step through in situ ATR-SEIRAS and DFT calculations. Therefore, the as-prepared Sc0.09-Cu2O catalyst presents improved eCO2RR to C2 product performance with a faradic efficiency of 71.9% at a current density of 600 mA cm−2.
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来源期刊
Advanced Functional Materials
Advanced Functional Materials 工程技术-材料科学:综合
CiteScore
29.50
自引率
4.20%
发文量
2086
审稿时长
2.1 months
期刊介绍: Firmly established as a top-tier materials science journal, Advanced Functional Materials reports breakthrough research in all aspects of materials science, including nanotechnology, chemistry, physics, and biology every week. Advanced Functional Materials is known for its rapid and fair peer review, quality content, and high impact, making it the first choice of the international materials science community.
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