在Cu-In单原子合金中的宿主-客金属相互作用 切换电催化CO2降解途径
Jia-Huan Du1, Ziwei Liu1, Tian Sheng2
1State Key Laboratory of Materials-Oriented Chemical Engineering, College of Chemical Engineering, Nanjing Tech University, Nanjing, 211816, China.
合金电催化剂通过控制主机-客机相互作用来显示可调节的二氧化碳减排路径. 单原子合金 (SAA) 通过改变铜中的 doping 来选择性地产生CO或HCOOH.
科学领域:
- 材料科学
- 电化学
- 催化剂
背景情况:
- 主体-客体金属相互作用极大地影响合金电催化剂的行为,影响吸附能量和产品的选择性.
- 由于复杂的成分和结构,在传统的双金属合金中发现活性位点是具有挑战性的.
研究的目的:
- 在Cu-In单原子合金 (SAA) 中研究宿主-客体金属相互作用.
- 在电化学二氧化碳减少反应 (CO2RR) 中证明路径切换.
- 阐明印兴奋剂在铜的活性部位中的作用.
主要方法:
- 不同组成的Cu-InSAA的合成和表征.
- 电化学CO2RR性能评估
- 在现场进行光谱测量.
- 密度函数理论 (DFT) 的模拟.
主要成果:
- 将1%的添加到Cu矩阵中产生了孤立的In-Cu接口,在CO2-CO转换方面达到90%的法拉代效率.
- 将1%的添加到矩阵中形成了CuIn合金,选择性转移到HCOOH,法拉第效率高于90%.
- DFT和现场研究证实Cu是活性部位,调节CO2吸附和*CO结合.
结论:
- 通过受控的主机-客户互动,Cu-In SAA提供可调节的CO2RR路径.
- 在原子层面的接口工程是选择性二氧化碳转换的关键.
- 了解金属对金属的相互作用对于设计先进的电催化剂至关重要.
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