v0.9.4

[0.9.4.]

Added

• VASP: Added a new logging statement to specifically highlight which parameters were swapped, not just which recommendations were made

Changed

• VASP: Removed EFERMI="midgap" automatic INCAR swap since it does not influence the results and prevents VASP 5.x compatibility. This should not impact most users since the presets have "midgap" set by default and even if the user did not do so, the emmet-based schemas automatically handles efermi handling.

Fixed

• Fixed MD5-based Atoms hashing to work on FIPS-encrypted OSs

What's Changed

• Refactor the runners some more by @Andrew-S-Rosen in #2238
• Bump maggma from 0.67.0 to 0.68.4 by @dependabot in #2239
• Bump pydantic-settings from 2.3.1 to 2.3.2 by @dependabot in #2241
• Bump pydantic from 2.7.3 to 2.7.4 by @dependabot in #2243
• Update init.py by @Andrew-S-Rosen in #2245
• Add a prefect test by @Andrew-S-Rosen in #2246
• Rename phonopy reqs by @Andrew-S-Rosen in #2248
• Remove efermi handling by @Andrew-S-Rosen in #2249
• Improve VASP logging by @Andrew-S-Rosen in #2250
• Bump prefect[dask] from 2.19.4 to 2.19.5 by @dependabot in #2252
• Bump dask[distributed] from 2024.5.2 to 2024.6.0 by @dependabot in #2251
• Bump pydantic-settings from 2.3.2 to 2.3.3 by @dependabot in #2253
• Fix Q-Chem type hint by @Andrew-S-Rosen in #2254
• Minor cleanup of run_opt by @Andrew-S-Rosen in #2255
• Add more mutability tests by @Andrew-S-Rosen in #2256
• Fix MD5 hash for FIPS encryption compatability by @Andrew-S-Rosen in #2258

Full Changelog: v0.9.3...v0.9.4