Pyxtal

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0.2.2

- support the recent major change in Pymatgen

0.2.1

- fix the scipy issue 126
- fix the bugs of reading and optimizing the lattice for molecular crystals
- adjust some error message to warning

0.2.0

- added a feature to generate the crystals with random seeds (133)
- supergroup function with improved atomic mapping scheme
- supergroup function of splitting from three sites to one site

0.1.9

- Fix the incompatibility issue with scipy 126
- added the function to search for alternative Wyckoff setting of a crystal structure 124
- supergroup function can work for most structures 120
- A bit clean up in the code according to PyLint 130

0.1.8

- fix the error in reading the seed for atomic crystals
- fix a minor bug in subgroup function
- improve the supergroup function

0.1.7

- Enabled the supergroup function
- Enabled the alternative setting option

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