Accelerating the Screening of Modified MA_2Z_4 Catalysts for Hydrogen Evolution Reaction by Deep Learning-Based Local Geometric Analysis
Machine learning(ML) integrated with density functional theory(DFT)calculations have recently been used to accelerate the des...
机 构:
Institute of Industrial Catalysis,State Key Laboratory Breeding Base of Green-Chemical Synthesis Technology,College of Chemical Engineering, Zhejiang University of Technology；School of Materials Science and Engineering,Zhengzhou University；School of Materials Science and Engineering,State Center for International Cooperation on Designer Low-Carbon & Environmental Materials (CDLCEM),Zhengzhou University；
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Energy & Environmental Materials
2024年06期
