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JuDFTteam / best-of-atomistic-machine-learning

🏆 A ranked list of awesome atomistic machine learning projects ⚛️🧬💎.
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Update project: JAX-DFT #254

Closed Irratzo closed 6 months ago

Irratzo commented 6 months ago

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Description: This library provides basic building blocks that can construct DFT calculations as a differentiable program.