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Cite this dataset Han, Y., Shepler, B. C., and Bowman, J. M. QM-22 Acetaldehyde singlet. ColabFit, 2025. https://doi.org/10.60732/27f8a97a
This dataset has been curated and formatted for the ColabFit Exchange
This dataset is also available on the ColabFit Exchange: Visit the ColabFit Exchange to search additional datasets by author, description, element content and more.… See the full description on the dataset page: https://huggingface.co/datasets/colabfit/QM-22_Acetaldehyde_singlet.