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Force-Aware Neural Tangent Kernels for Scalable and Robust Active Learning of MLIPs
提出力感知神经切线核方法,攻克机器学习力场主动学习在大规模候选池及偏差下的扩展性与鲁棒性难题
arXiv:2605.13788v2 Announce Type: replace Abstract: Active learning for machine-learning interatomic potentials (MLIPs) must address several challenge…