2 datasets found

Keywords: atomistic machine learning

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  • Randomly-displaced methane configurations

    Most of the datasets to benchmark machine-learning models contain minimum-energy structures, or small fluctuations around stable geometries, and focus on the diversity of...

  • Randomly-displaced methane configurations

    Most of the datasets to benchmark machine-learning models contain minimum-energy structures, or small fluctuations around stable geometries, and focus on the diversity of...
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