Lv3
250 积分 2024-02-20 加入
Exploring dynamics in single atom catalyst research: A comprehensive DFT-kMC study of nitrogen reduction reaction with focus on TM aggregation
13天前
已关闭
A Universal Descriptor for the Screening of Electrode Materials for Multiple-Electron Processes: Beyond the Thermodynamic Overpotential
14天前
已完结
Screening Janus-2H-WSSe with Adsorbed Transition Metals as Efficient Catalyst for Nitrogen Reduction Reaction
1个月前
已完结
Computational Screening of Efficient Single‐Atom Catalysts Based on Graphitic Carbon Nitride (g‐C3N4) for Nitrogen Electroreduction
6个月前
已完结
Transition metals anchored on two-dimensional p-BN support with center-coordination scaling relationship descriptor for spontaneous visible-light-driven photocatalytic nitrogen reduction
6个月前
已完结
High‐Throughput Screening of Electrocatalysts for Nitrogen Reduction Reactions Accelerated by Interpretable Intrinsic Descriptor
8个月前
已完结
Machine Learning Accelerated Screening Advanced Single-Atom Anchored MXenes Electrocatalyst for Nitrogen Fixation
8个月前
已完结
Thermal conductivities in NaSnAs, NaSnP, andNaSn2As2: Effect of double lone-pair electrons
11个月前
已完结
Ammonia as a renewable energy carrier from synthesis to utilization
11个月前
已完结
Synergizing Machine Learning with High‐Throughput DFT to Design Efficient Single‐Atom Catalysts for Hydrogen Evolution Reaction
11个月前
已完结
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