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20212026
most citedTransition1x -- a Dataset for Building Generalizable Reactive Machine Learning Potentials

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cond-mat.mtrl-sci2026

SoLiD26: A First Principles Solid-Liquid Interface Dataset for Machine-learned Interatomic Potentials

Jonas Busk, Emil J. P. Frost, Yogeshwaran Krishnan +7

Machine-learned interatomic potentials (MLIPs) enable simulations of larger atomistic systems over longer timescales than traditional ab initio methods but require large, diverse t…