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Tuning the Activity and Selectivity of Nitrogen Reduction Reaction on Double-Atom Catalysts by B Doping: A Density Functional Theory Study
1小时前
求助中
Hydrogen Migration Enhances Proton‐Coupled Electron Transfer in an S‐Scheme Heterojunction for High‐Efficiency Photocatalysis
12天前
已完结
Density functional theory and machine learning method for the rapid screening of dual-atom catalysts in N2 electroreduction
12天前
已完结
Suppression of Hydrogen Evolution Reaction in Electrochemical N2 Reduction Using Single-Atom Catalysts: A Computational Guideline
12天前
已完结
Machine Learning-Assisted Screening of Non-Adjacent Dual-Atom Catalysts on N-Doped Graphene: Insights Into the Electron "Storage-Feedback" Mechanism for N2 Reduction
15天前
已完结
Machine-learning-assisted high-throughput screening for accelerating the discovery of diatomic catalysts in N 2 electroreduction
20天前
已完结
Potential-dependent NRR/HER competition and N 2 activation mechanism in M1M2@C 6 N 6 bimetallic catalysts
20天前
已完结
Evaluating the Catalytic Efficiency of Paired, Single-Atom Catalysts for the Oxygen Reduction Reaction
21天前
已完结
Coordination of Atomic Co–Pt Coupling Species at Carbon Defects as Active Sites for Oxygen Reduction Reaction
1个月前
已完结
Cooperative Single-Atom Active Centers for Attenuating the Linear Scaling Effect in the Nitrogen Reduction Reaction
1个月前
已完结
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