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README.md
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Trained checkpoints for **OrbFlow**, which predicts atomic-orbital expansion coefficients (and the resulting
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electron density) with equivariant flow matching.
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- Code: https://github.com/
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- Data: [divelab/OrbFlow-data](https://huggingface.co/datasets/divelab/OrbFlow-data)
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- Paper: TODO
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Trained checkpoints for **OrbFlow**, which predicts atomic-orbital expansion coefficients (and the resulting
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electron density) with equivariant flow matching.
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- Code: https://github.com/divelab/AIRS/tree/main/OpenDFT/OrbFlow
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- Data: [divelab/OrbFlow-data](https://huggingface.co/datasets/divelab/OrbFlow-data)
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- Paper: TODO
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