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QM9

The QM9 dataset contains approximately 133,000 organic molecules composed of elements such as H, C, N, O, and F, used for predicting molecular properties like internal energy.

Data and Resources

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Cite this as

Raghunathan Ramakrishnan, Pavlo O Dral, Matthias Rupp, O Anatole von Lilienfeld (2024). Dataset: QM9. https://doi.org/10.57702/exp0m45r

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Additional Info

Field	Value
Created	November 25, 2024
Last update	November 25, 2024
Defined In	https://doi.org/10.48550/arXiv.1810.09751
Author	Raghunathan Ramakrishnan
More Authors	Pavlo O Dral Matthias Rupp O Anatole von Lilienfeld