v0.3.4
Summary
Added
- Added a new documentation section for worked examples on HPC.
Changed
- Updated the minimum required versions for Pymatgen and emmet-core to reflect Pydantic 2 update.
- Added
symprec=1e-8
to the default parameters of VASP relaxation jobs. - VASP bulk recipes now use "BulkSet" as the default preset instead of
None
. - VASP slab recipes now use "SlabSet" as the default preset instead of
None
.
What's Changed
- Improve the deployment docs by @Andrew-S-Rosen in #1025
- Bump emmet-core and pymatgen by @Andrew-S-Rosen in #1028
- Add default presets in VASP recipes by @Andrew-S-Rosen in #1029
Full Changelog: v0.3.3...v0.3.4