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Updated: May 12, 2025

Author Spotlight: Magnetometric Characterization of Intermediates in the Solid-State Electrochemistry of Redox-Active Metal-Organic Frameworks
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单金属双原子二维二氧化碳电还原金属有机框架:结合密度函数理论和机器学习的研究

Zhou Wang1, Lin Cheng1, Huiyan Ma1

  • 1College of Chemical Engineering, Inner Mongolia University of Technology, Inner Mongolia Key Laboratory of Theoretical and Computational Chemistry Simulation, Hohhot 010051, PR China.

Journal of colloid and interface science
|May 8, 2025
PubMed
概括

研究人员探索了14个二维相结合的金属有机框架 (2D c-MOFs) 用于电化学二氧化碳减排 (CO2RR). 四种PCM-O8-M材料显示出高活性和对C1产品的选择性,电位从-0.47V到0V.

关键词:
2D结合金属有机框架减少反应反应的二氧化碳.密度函数理论密度函数理论机器学习 机器学习一种单金属的双原子位点.

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