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jablonkagroup/formation_energies

Dataset Details Dataset Description Formation and decomposition energies of inorganic solids mined from the Materials Project database. Curated by: License: CC BY 4.0 Dataset Sources original data source Citation BibTeX: @article{Bartel_2020, doi = {10.1038/s41524-020-00362-y}, url = {https://doi.org/10.1038%2Fs41524-020-00362-y}, year = 2020, month = {jul}, publisher = {Springer Science and Business Media {LLC}}… See the full description on the dataset page: https://huggingface.co/datasets/jablonkagroup/formation_energies.

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Dataset Details

Dataset Description

Formation and decomposition energies of inorganic solids mined from the Materials Project database.

  • —Curated by:
  • —License: CC BY 4.0

Dataset Sources

Citation

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BibTeX:

bibtex
@article{Bartel_2020,
  doi = {10.1038/s41524-020-00362-y},
  url = {https://doi.org/10.1038%2Fs41524-020-00362-y},
  year = 2020,
  month = {jul},
  publisher = {Springer Science and Business Media {LLC}},
  volume = {6},
  number = {1},
  author = {Christopher J. Bartel and Amalie Trewartha and Qi Wang and Alexander Dunn and Anubhav Jain and Gerbrand Ceder},
  title = {A critical examination of compound stability predictions from machine-learned formation energies},
  journal = {npj Comput Mater}
}