Artrith, Nongnuch

1. Overcoming the Size Limit of First Principles Molecular Dynamics Simulations with an In-Distribution Substructure Embedding Active Learner
   2023/11/14 by Lingyu Kong, Kong, Lingyu, Jielan Li +17 · 1 citation
   Computer Science · Engineering · Materials Science · #Computational Physics (physics.comp-ph) #FOS: Physical sciences #Machine Learning and Algorithms #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #Microfluidic and Capillary Electrophoresis Applications
2. Simulated sulfur K-edge X-ray absorption spectroscopy database of lithium thiophosphate solid electrolytes
   2023/01/31 by Haoyue Guo, Matthew R. Carbone, Guo, Haoyue +21 · 1 citation
   Engineering · Materials Science · Physics and Astronomy · #Advanced Battery Materials and Technologies #FOS: Physical sciences #Glass properties and applications #Materials Science (cond-mat.mtrl-sci) #X-ray Spectroscopy and Fluorescence Analysis
3. Bayesian Neural Networks versus deep ensembles for uncertainty quantification in machine learning interatomic potentials
   2025/09/23 by Riccardo Farris, Farris, Riccardo, Emanuele Telari +7 · 2 citations
   Computer Science · Materials Science · Physics and Astronomy · #Chemical Physics (physics.chem-ph) #Computational Drug Discovery Methods #FOS: Physical sciences #Machine Learning in Materials Science #Materials Science (cond-mat.mtrl-sci) #Model Reduction and Neural Networks