Pyxtal-ff

Latest version: v0.2.3

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0.2.3

- [add weight_on option to SO3](https://github.com/MaterSim/PyXtal_FF/commit/afaf729858b4a73b9c9de7234949f21828b5e4ff)

0.2.2

- Fix a bug in dealing the stress for linear regression

0.2.1

- Fix some bugs in E/F/S calculator from pyxtal_ff calculator

0.2.0

- improve the workflow
- add the get_dispaced_atom function for phonon object
- add the example to illustrate the idea of mutibatch

0.1.9

- Enabled optimization under pressure
- Fixed the bug of phonon calculation for multi-component systems

0.1.8

- Fix the issue of rdxdr calculation for ACSF and EAMD
- Full support of zbl
- Fully consistent results of SO3/SNAP between pyxtal_ff and LAMMPS

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