MLIP Benchmark
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资源简介：
Here we provide the following zipped due to limitations on the number of files in Zenodo. Datasets: The database of datasets used in the benchmark with 3 splits. ~3.8 GB Analysis: Additional analysis scripts and minor datasets used to validate observable properties. ~11 MB Speed: The LAMMPS input for performing our speed tests for each MLIP. ~55 KB Please note that the Zr-O dataset comes from the referenced work by Waters et. al with permission.
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Zenodo创建时间：
2025-06-07
