v0.3.6
What's Changed
- bugfix for stress loss by @JPDarby in #438
- change stress normalization + setup.cfg with numpy<2.0 by @ilyes319 in #467
- fix universal loss stress by default by @ilyes319 in #472
- Support for schedulefree optimizer by @RokasEl in #477
- Add Command-Line Argument for Specifying Wandb Directory by @nqhq-lou in #466
- Add DOI badge and automated release by @ElliottKasoar in #404
- Merge latest develop by @ilyes319 in #480
- remove DOI from badge by @ilyes319 in #482
- add finetuning to readme TOC by @ilyes319 in #485
- add support for hessian in calculator by @ilyes319 in #486
- prepare the model for hessian by @ilyes319 in #490
- BUG: Single atoms not isolated incorrectly removed from training set by @jameskermode in #492
- Fix bug with isolated atoms by @ilyes319 in #493
- correct pbc extension by @ilyes319 in #506
- change dynamo to optional by @ilyes319 in #510
- Simplify installation steps by @vue1999 in #514
- Develop by @ilyes319 in #515
- remove Literal for python >3.9 by @ilyes319 in #516
New Contributors
- @JPDarby made their first contribution in #438
- @nqhq-lou made their first contribution in #466
- @ElliottKasoar made their first contribution in #404
- @jameskermode made their first contribution in #492
Full Changelog: v0.3.5...v0.3.6