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DOE OSTI · 2335917

Data for: "Data efficiency and extrapolation trends in neural network interatomic potentials"

Abstract

Data to reproduce the paper "Data efficiency and extrapolation trends in neural network interatomic potentials" (LLNL-JRNL-845001). Contains: plots, results, and visualization scripts. Preprint available at https://doi.org/10.48550/arXiv.2302.05823.

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BibTeXRIS

Schwalbe Koda, Daniel, Vita, Joshua. 2023-01-01. Data for: "Data efficiency and extrapolation trends in neural network interatomic potentials". https://doi.org/10.11579/2335917

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