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机器学习加速催化剂设计 被引量:1

Accelerating catalysts design by machine learning
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摘要 The climate crisis associated with rapid accumulation of carbon dioxide in atmosphere has posed increasing threat to human wellbeings[1].It is of great significance to capture and convert CO2 to realize sustainable utilization of carbon resources[1].The electrocatalytic CO2 reduction reaction(CO2RR)provides a sustainable,carbon-neutral method for solving this problem.Yet the difficulty of finding an efficient catalysts slows down the realization of the ambitious goal.It is mainly because it requires simultaneous optimization of selectivity for a specific product,energy conversion efficiency,current density and stability of the reaction system.
作者 余海山 江俊 Haishan Yu;Jun Jiang(Hefei National Laboratory for Physical Sciences at the Microscale,CAS Key Laboratory of Mechanical Behavior and Design of Materials,School of Chemistry and Materials Science,University of Science and Technology of China,Hefei 230026,China)
出处 《Science Bulletin》 SCIE EI CAS CSCD 2020年第19期1593-1594,共3页 科学通报(英文版)
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