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Notes

Dataset Submission Guidelines

  • Worked on PR, added specifics on versioning, naming, tags, etc.

DANCE dataset submission

  • Reviewed and submitted!

  • Used new submission guidelines from above

WBO submission

  • If added to dataset, this should trigger a new calculation?

  • we may be adding some of these in the near future to existing datasets

Tagging for routing of problem cases

  • not possible to add new compute tags post submission

  • could potentially be added, but current approach is to run problem calcs on a local instance of QCA (David doing this on own server)

Action items

  •  David Dotson will create a QCFractal issue for compute tag addition post-submission (not urgent)
  •  Trevor Gokey will create an issue for adding DOIs to datasets, and for this to be queryable

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