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680 积分 2024-09-14 加入
Automatic Generation of Chemical Mechanisms for Electrochemical Systems: Solid Electrolyte Interphase Formation in Lithium Batteries
35分钟前
待确认
Chemprop: A Machine Learning Package for Chemical Property Prediction
1天前
待确认
A machine learning method to predict rate constants for various reactions in combustion kinetic models
2天前
已完结
Theoretical Prediction of the Strong Solvent Effect on Reduced Ethylene Carbonate Ring-Opening and Its Impact on Solid Electrolyte Interphase Evolution
3天前
已完结
Simulations of dendrite and crack and their interactions in solid electrolyte by phase field method
4天前
已完结
Automated Transition State Search and Its Application to Diverse Types of Organic Reactions
9天前
已关闭
Reactions of Singly-Reduced Ethylene Carbonate in Lithium Battery Electrolytes: A Molecular Dynamics Simulation Study Using the ReaxFF
9天前
已完结
Graph-Theory Algorithm for Prediction of Electrolyte Degradation Reactions in Lithium- and Sodium-Ion Batteries
9天前
已完结
First principles molecular dynamics simulation and thermal decomposition kinetics study of CL-20
10天前
已完结
Temperature-dependent solid electrolyte interphase reactions drive performance in lithium-mediated nitrogen reduction to ammonia
10天前
已完结
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