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Update CHANGELOG.md
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Andrew-S-Rosen committed Jan 5, 2024
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Expand Up @@ -8,16 +8,21 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/),

### Added

- Adds `quacc.recipes.espresso.core.relax_job` and `quacc.recipes.espresso.core.post_processing_job`
- Adds a new `ase_relax_job` for ORCA
- Adds a new `relax_job` and `post_processing_job` for Quantum Espresso
- `quacc.wflow_tools.customizers.strip_decorator` and `quacc.wflow_tools.customizers.redecorate` are imported in the base `__init__.py` for easy user access
- The CLI now has *color*

### Changed

- The test suite's SCRATCH_DIR and RESULTS_DIR are now fixed to a given location
- The default Espresso preset has been changed to "sssp_1.3.0_pbe_efficiency"
- To remove calculator defaults entirely, `quacc.Remove` is recommended in place of `None`
- The `quacc.wflow_tools.customizers.strip_decorator` function is recommended instead of calling `.__wrapped__`

### Fixed

- Fixed Dask subflows that were calling `.compute()`
- Fixed various bugs in the Espresso calculator and recipes

## [0.5.0]
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