v1.1.5
1.1.5
Added
- Improved TorchSim recipes and added tutorials
Fixed
- Fixed
copy_filesso it ignores Custodian error folders
What's Changed
- Bump prefect[dask] from 3.6.9 to 3.6.10 by @dependabot[bot] in #3106
- Bump parsl[monitoring] from 2026.1.5 to 2026.1.12 by @dependabot[bot] in #3107
- Correct call params to write_espresso_ph (changed in ase on 01/13/26) by @vineetbansal in #3111
- Automatically calculate energy, forces, stress in TorchSim + add tutorial by @orionarcher in #3110
- Move error folder check to the correct location by @Andrew-S-Rosen in #3112
New Contributors
- @vineetbansal made their first contribution in #3111
Full Changelog: v1.1.4...v1.1.5