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Bibliographic Details
Main Authors: Maxson, Tristan, Soyemi, Ademola, Zhang, Xinglong, Chen, Benjamin Wei Jie, Szilvasi, Tibor
Format: Recurso digital
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Published: Zenodo 2024
Online Access:https://doi.org/10.5281/zenodo.10901820
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Table of Contents:
  • <p>Here we provide the following zipped due to limitations on the number of files in Zenodo.</p> <ul> <li>Datasets: The database of datasets used in the benchmark with 3 splits. ~3.8 GB</li> <li>Analysis: Additional analysis scripts and minor datasets used to validate observable properties. ~11 MB</li> <li>Speed: The LAMMPS input for performing our speed tests for each MLIP. ~55 KB</li> </ul> <p>Please note that the Zr-O dataset comes from the referenced work by Waters et. al with permission.</p>