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1. Fine-tuned-Perovs-IAP-for-Unified-Perovskite-Structure-Optimization Fine-tuned-Perovs-IAP-for-Unified-Perovskite-Structure-Optimization Public

   Fine-tuning M3GNet-IAP on Mannodi group HT-DFT dataset

   Jupyter Notebook 5 2

2. Multi-fidelity-screening-of-perovskite-photocatalysts Multi-fidelity-screening-of-perovskite-photocatalysts Public

   Jupyter Notebook 2 1

3. Activation-steering-for-XRD Activation-steering-for-XRD Public

   Python

4. Hardness-estimation-using-Genetic-Programming Hardness-estimation-using-Genetic-Programming Public

   Jupyter Notebook

5. xrd_simulator xrd_simulator Public

   Forked from FABLE-3DXRD/xrd_simulator

   Tools for simulating x-ray diffraction. Detailed documentation is found at the below link.

   Python