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  1. VibroML VibroML Public

    VibroML: Machine-Learning Vibrational Analysis & Stability

    Python 11

  2. MatterVial MatterVial Public

    MatterVial is a featurizer tool designed for materials science, leveraging both graph-neural networks (GNNs) and traditional feature engineering to extract valuable chemical information from materi…

    Jupyter Notebook 5 4

  3. ProtoCSP ProtoCSP Public

    Accelerated discovery of solid solutions, high-entropy alloys, and complex crystals through prototype transmutation and machine learning interatomic potential (MLIP) validation.

    Python 4