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60 积分 2024-08-16 加入
Optimizing CO2 electroreduction: theoretical insights for enhancing efficiency across elementary steps
10小时前
已完结
Improving Nitric Oxide Reduction Reaction Activity of TMN4–C Model Catalysts by Axial Atom Coordination
10天前
已完结
Machine learning–enabled high-entropy alloy discovery
6个月前
已完结
XRDMatch: A Semi-Supervised Learning Framework to Efficiently Discover Room Temperature Lithium Superionic Conductors
6个月前
已完结
Electrocatalytic reduction of nitrogenous pollutants to ammonia
9个月前
已完结
Recent advances in electrocatalytic upgrading of nitric oxide and beyond
9个月前
已完结
Precise Construction of High Metallicity and High Stability TM1/Cu2O(111) Single-Atom Catalysts by First-Principles
1年前
已完结
Theoretical Insights into Lanthanide Rare Earth Single-Atom Catalysts for Electrochemical CO2 Reduction
1年前
已完结
Revealing the oxygen Reduction/Evolution reaction activity origin of Carbon-Nitride-Related Single-Atom catalysts: Quantum chemistry in artificial intelligence
1年前
已完结
Unveiling “Sabatier principle” for electrocatalytic nitric oxide reduction on single cluster catalysts: A DFT and machine learning guideline
1年前
已完结
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