v0.1.2
What's Changed
Other Changes
- Bump matgl from 2.0.6 to 2.1.1 by @dependabot[bot] in #1426
- Bump torch from 2.2.0 to 2.11.0 by @dependabot[bot] in #1445
- Bump fireworks from 2.1.2 to 2.1.3 by @dependabot[bot] in #1453
- Bump mattersim from 1.2.1 to 1.2.2 by @dependabot[bot] in #1454
- Update ase requirement from <3.28.0 to <3.29.0 by @dependabot[bot] in #1432
- [WIP] Job execution tutorial by @ml-evs in #773
- MLFF dependency groups by @esoteric-ephemera in #1455
- Bump openmm from 8.5.0 to 8.5.1 by @dependabot[bot] in #1457
- Bump pytest from 9.0.2 to 9.0.3 by @dependabot[bot] in #1458
- Forcefield roundtrip when specifying monty dict by @esoteric-ephemera in #1461
- Update reading output files in FHI-aims SocketIO workflow by @ansobolev in #1463
- Auto-update pre-commit hooks by @github-actions[bot] in #1459
New Contributors
Full Changelog: v0.1.1...v0.1.2