30 citations · 35 across the 3 of their papers we have counts for
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cond-mat.mtrl-sci2023★ 3 cited
Overcoming the Size Limit of First Principles Molecular Dynamics Simulations with an In-Distribution Substructure Embedding Active Learner
Lingyu Kong, Jielan Li, Lixin Sun +7
Large-scale first principles molecular dynamics are crucial for simulating complex processes in chemical, biomedical, and materials sciences. However, the unfavorable time complexi…
cond-mat.mtrl-sci2022★ 2 cited
The Intercalation Chemistry of the Disordered RockSalt Li3V2O5 Anode from Cluster Expansions and Machine Learning Interatomic Potentials
Xingyu Guo, Chi Chen, Shyue Ping Ong
Disordered rocksalt (DRX) Li3V2O5 is a promising candidate for anode in rechargeable lithium-ion batteries because of its ideal low voltage, high rate capability, and superior cycl…