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  1. CASHgen CASHgen Public

    Python 6 3

  2. A-curated-atomistic-dataset-and-machine-learning-potential-for-calcium-aluminate-silicate-hydrates A-curated-atomistic-dataset-and-machine-learning-potential-for-calcium-aluminate-silicate-hydrates Public

    DFT-labeled C–A–S–H atomistic dataset and trained CASH-MLP for machine-learning molecular dynamics of calcium aluminate silicate hydrates.