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32 积分 2024-07-14 加入
From Characterization to Discovery: Artificial Intelligence, Machine Learning and High-Throughput Experiments for Heterogeneous Catalyst Design
5天前
已完结
Revisiting the universal principle for the rational design of single-atom electrocatalysts
14天前
已完结
Machine learning-based high throughput screening for nitrogen fixation on boron-doped single atom catalysts
14天前
已完结
Regulating the coordination structure of metal single atoms for efficient electrocatalytic CO2 reduction
15天前
已完结
Isolated Metal Atom Geometries as a Strategy for Selective Heterogeneous Hydrogenations
15天前
已完结
Rational design of single transition-metal atoms anchored on a PtSe2 monolayer as bifunctional OER/ORR electrocatalysts: a defect chemistry and machine learning study
21天前
已完结
High throughput screening of single atomic catalysts with optimized local structures for the electrochemical oxygen reduction by machine learning
21天前
已完结
Machine learning-driven shortening the screening process towards high-performance nitrogen reduction reaction electrocatalysts with four-step screening strategy
1个月前
已完结
Screened (Co, Rh, Ir)–N4 graphene single atom catalysts for hydrogen production via tunable surrounding coordination shell: Computation and machine learning
1个月前
已完结
Understanding the hydrogen evolution reaction activity of doped single-atom catalysts on two-dimensional GaPS4 by DFT and machine learning
1个月前
已完结
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