Generate the report using picometers [pm] instead of Angströms

dkratzert / FinalCif

A CIF file finalizer for small molecule crystallography with as much automation as possible.

https://dkratzert.de/finalcif.html

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Open dkratzert opened 1 week ago

dkratzert commented 1 week ago

I see two possible solutions:

Make a Jinja filter for the lengths in templates and create a template fro pm.
Make lengths in the template more general by creating a unit tag and switch between units in python.

Both solutions must deal with the esd. correctly when values are converted between units.