Lv31
218 积分 2025-12-20 加入
Sella, an Open-Source Automation-Friendly Molecular Saddle Point Optimizer
1小时前
已完结
Why Is Methanol Formation Suppressed in CO 2 Reduction Over Copper Electrocatalysts?
1个月前
已完结
Dielectric loss-driven microwave absorbing materials
2个月前
已完结
High-throughput transition-state searches in zeolite nanopores
3个月前
已完结
High-throughput transition-state searches in zeolite nanopores
3个月前
已关闭
Discovering Electron‐Sponge Behavior at Organic‐Metal Interfaces for CO 2 Electroreduction via Machine Learning
3个月前
已完结
Foundation models for atomistic simulation of chemistry and materials
3个月前
已完结
CaTS: Toward Scalable and Efficient Transition State Screening for Catalyst Discovery
4个月前
已完结
Accelerating Transition State Search and Ligand Screening for Organometallic Catalysis with Reactive Machine Learning Potential
4个月前
已完结
Deep Learning Guided Exploration of Transition Metal Oxide Catalysts in Acetylene Selective Hydrogenation
5个月前
已完结
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