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Predicting formation energy from crystal structure
Predict the DFT formation energy of a crystal in eV/atom from its structure, over 132,752 entries.
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基线保持在 MAE (eV/atom) 0.017。
Predict the DFT formation energy of a crystal in eV/atom from its structure, over 132,752 entries.
基线保持在 MAE (eV/atom) 0.017。