Releases: qzhu2017/PyXtal
Releases · qzhu2017/PyXtal
PyXtal-v0.6.7
PyXtal-v0.6.6
PyXtal-v0.6.5
- Improve the site-symmetry notation #249
- Improve the handling of smiles string and representation for molecular crystals.
PyXtal-v0.6.4
PyXtal-v0.6.3
Enabled the get_forcefield function
PyXtal-v0.6.2 (Action)
Improve the functionality for molecular module and manage PyPI upload via GitHub action.
To test...