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Update README.md
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Eipgen authored Dec 16, 2024
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Expand Up @@ -294,6 +294,9 @@ FeNNol is a library for building, training and running neural network potentials
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- [ OrbNet-Equi](https://doi.org/10.1073/pnas.2205221119)
INFORMING GEOMETRIC DEEP LEARNING WITH ELECTRONIC INTERACTIONS TO ACCELERATE QUANTUM CHEMISTRY
- [OrbNet-Spin](https://ml4physicalsciences.github.io/2024/files/NeurIPS_ML4PS_2024_214.pdf)
OrbNet-Spin incorporates a spin-polarized treatment into the underlying semiempirical quantum mechanics orbital featurization and adjusts the model architecture accordingly while maintaining the geometrical constraints.

- [AIQM1](https://doi.org/10.1038/s41467-021-27340-2)
<br>Artificial intelligence-enhanced quantum chemical method with broad applicability.
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