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3C Artificial Intelligence for Materials Science group · GitHub
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Artificial Intelligence for Materials Science group

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  1. gcnn_keras gcnn_keras Public

    Graph convolutions in Keras with TensorFlow, PyTorch or Jax.

    Jupyter Notebook 116 31

  2. MOF_Synthesis_Prediction MOF_Synthesis_Prediction Public

    Jupyter Notebook 36 4

  3. 3DSC 3DSC Public

    Repo for the paper publishing the superconductor database with 3D crystal structures.

    Jupyter Notebook 20 5

  4. ChemMatData ChemMatData Public

    An overview over chemical datasets and where to find them

    17 2

  5. graph_attention_student graph_attention_student Public

    Minimal implementation of graph attention student model architecture

    Python 11 2

  6. perovskite_htm_screening perovskite_htm_screening Public

    Code for paper "Accelerating the discovery of materials for integrated/complex device"

    Python 11 4

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