You're currently viewing an old version of this dataset. To see the current version, click here.

QM7

The Quantum Chemistry dataset contains 7165 molecules. Each molecule is represented by the Coulomb (energy) matrix and its atomization energy.

Data and Resources

This dataset has no data

Cite this as

Ming Lia, Zheng Ma, Yu Guang Wang, Xiaosheng Zhuang (2024). Dataset: QM7. https://doi.org/10.57702/klf8ug6q

Private DOI This DOI is not yet resolvable.
It is available for use in manuscripts, and will be published when the Dataset is made public.

Additional Info

Field Value
Created December 16, 2024
Last update December 16, 2024
Defined In https://doi.org/10.48550/arXiv.1907.04786
Author Ming Lia
More Authors
Zheng Ma
Yu Guang Wang
Xiaosheng Zhuang