Changelog¶
0.1.2 (2022-02-01)¶
Given zero values for B_iso are now ignored.
Added an option to add some work-related options.
0.1.1 (2022-01-05)¶
Now checks for negative fractional coordinates
Adds MVW(0,0,0) to strs
Adds a comment containing the original unit cell prms so you can easily undo them
0.1.0 (2021-11-07)¶
It looks like everything is working!
0.0.0 (2021-11-07)¶
First release on PyPI.