3 papers
cs.LG2025
Geometric Mixture Models for Electrolyte Conductivity Prediction
Anyi Li, Jiacheng Cen, Songyou Li +3
Accurate prediction of ionic conductivity in electrolyte systems is crucial for advancing numerous scientific and technological applications. While significant progress has been ma…
cs.LG2025
Fast and Distributed Equivariant Graph Neural Networks by Virtual Node Learning
Yuelin Zhang, Jiacheng Cen, Jiaqi Han +1
Equivariant Graph Neural Networks (GNNs) have achieved remarkable success across diverse scientific applications. However, existing approaches face critical efficiency challenges w…
cs.LG2024
Are High-Degree Representations Really Unnecessary in Equivariant Graph Neural Networks?
Jiacheng Cen, Anyi Li, Ning Lin +3
Equivariant Graph Neural Networks (GNNs) that incorporate E(3) symmetry have achieved significant success in various scientific applications. As one of the most successful models,…