pyiron_atomistics 0.3.0
·
1960 commits
to main
since this release
With the release of pyiron_atomistics 0.3.0 Python 3.8 support is dropped in favor of typing in Python >= 3.9.
What's Changed
- Bump mp-api from 0.33.2 to 0.33.3 by @dependabot in #1049
- Bump seekpath from 2.0.1 to 2.1.0 by @dependabot in #1050
- Bump phonopy from 2.19.0 to 2.19.1 by @dependabot in #1051
- Not store useless extra species info in
Atoms
by @samwaseda in #982 - Update pyiron_base to 0.5.39 by @jan-janssen in #1052
- VASP: Parse the number of steps correctly from OUTCAR by @pmrv in #1018
- [minor] Remove superfluous cell multiplication by @samwaseda in #1061
- Bump pandas from 2.0.1 to 2.0.2 by @dependabot in #1065
- Make potential algebraic by @samwaseda in #1008
- Correct spelling issues by @jan-janssen in #1063
- Remove Atoms().visualize by @jan-janssen in #1053
- Fix for spins by @jan-janssen in #1055
- Fix test for spins by @niklassiemer in #1074
- Bump pymatgen from 2023.5.10 to 2023.5.31 by @dependabot in #1075
- Pickle atoms by @liamhuber in #1036
- Use intermediate PR_TITLE variable to secure workflow by @niklassiemer in #1076
- Update pyiron_base to 0.5.42 by @jan-janssen in #1077
- Disable Python 3.8 - update pyiron_base 0.6.0 by @jan-janssen in #1078
Full Changelog: pyiron_atomistics-0.2.67...pyiron_atomistics-0.3.0