Preferred Networks

NeurIPS2025 ML4PS

P-DRUM: Post-hoc Descriptor-based Residual Uncertainty Modeling for Machine Learning Potentials

材料科学/計算化学

By : Shih-Peng Huang, Nontawat Charoenphakdee, Yuta Tsuboi, Yong-Bin Zhuang, Wenwen Li

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