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英文字典中文字典相关资料:


  • Matbench Discovery
    Matbench Discovery is an interactive leaderboard which ranks ML models on multiple tasks designed to simulate high-throughput discovery of new stable inorganic crystals, finding their ground state atomic positions and predicting their thermal conductivity
  • models sevennet-omni-i12 • Matbench Discovery
    Matbench Discovery - Benchmarking machine learning energy models for materials discovery
  • data • Matbench Discovery
    Matbench Discovery takes these as ground truth for material stability Any value above 0 is assumed to be an unstable metastable material site_stats_fingerprint_init_final_norm_diff: The norm of the difference between the initial and final site fingerprints This is a volume-independent measure of how much the structure changed during DFT
  • models • Matbench Discovery
    EquiformerV3+DeNS-OAM Repo Paper Docs Checkpoint Files Training data: OMat24 + MPtrj + sAlex Added 2026-04-07 Published 2026-04-07 30 3M params Missing preds: 0
  • contribute • Matbench Discovery
    Add the model to the Model enum in matbench_discovery enums py pointing to the correct metadata file [!WARNING] Do not include a filter_bad_preds py script or equivalent This was a historical flaw in the evaluation and now all OOM outlier prediction handling is handled internally and consistently removing the need for this filtering stage





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