CheMFi: A Multifidelity Dataset of Quantum Chemical Properties of Diverse Molecules

doi:doi:10.57702/wscga2ud

CheMFi: A Multifidelity Dataset of Quantum Chemical Properties of Diverse Molecules

A diverse collection of multifidelity QC properties for 9 molecules, calculated at 5 different fidelities.

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Original MetadataJSON
The json representation of the dataset with its distributions based on DCAT.
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Cite this as

Vivin Vinod, Peter Zaspel (2024). Dataset: CheMFi: A Multifidelity Dataset of Quantum Chemical Properties of Diverse Molecules. https://doi.org/10.57702/wscga2ud

DOI retrieved: December 16, 2024

Additional Info

Field	Value
Created	December 16, 2024
Last update	December 16, 2024
Defined In	https://doi.org/10.48550/arXiv.2406.14149
Author	Vivin Vinod
More Authors	Peter Zaspel
Homepage	https://zenodo.org/records/11636903