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1. OMatGRPO OMatGRPO Public

   GRPO on the OMatG crystal generator, with RL on the discrete composition channel and a reward guarded against reward hacking. Code for arXiv:2610.03880.

   Python

2. GuidedMatDiffusion GuidedMatDiffusion Public

   Guided diffusion for the Discovery of New Superconductors

   Jupyter Notebook 7 3

3. FERMat-ML/OMatG FERMat-ML/OMatG Public

   Generative framework for crystal structure prediction and de novo generation of inorganic crystals.

   Python 58 7

4. henniggroup/BEE-NET henniggroup/BEE-NET Public

   Bootstrapped Ensemble of Equivariant Graph Neural Networks (BEE-NET), a machine-learning model trained to predict the Eliashberg spectral function and superconducting critical temperature.

   Jupyter Notebook 4 1

5. stem_infilling stem_infilling Public

   Python

6. paprakash.github.io paprakash.github.io Public

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