ispg-group / aiidalab-ispg

ATMOSPEC: ab initio UV/vis spectroscopy for everyone
MIT License
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PhotolysisWidget: Validate photolysis rate constant value #202

Closed danielhollas closed 1 year ago

danielhollas commented 1 year ago

Use data from our paper with cate to validate both differential j and total j.

Also make sure that mask_data functions works correctly on various edge cases. Also probably needs a refactor, as it is now rather confusing...