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1 | 1 | # Change log
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2 | 2 |
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| 3 | +## v0.0.19 |
| 4 | + |
| 5 | +### Bug Fixes 🐛 |
| 6 | +* CP2K fixes by @janosh in https://github.com/materialsproject/atomate2/pull/1056 |
| 7 | +* bug fix for linear strain passing in qha by @JaGeo in https://github.com/materialsproject/atomate2/pull/1061 |
| 8 | +* Fix `generate_phonon_displacements` magmom removal side effect by @janosh in https://github.com/materialsproject/atomate2/pull/1064 |
| 9 | +* Fixed Failing Abinit tests bis by @VicTrqt in https://github.com/materialsproject/atomate2/pull/1108 |
| 10 | +### Enhancements 🛠 |
| 11 | +* Add trajectory reporter to openmm workflow by @orionarcher in https://github.com/materialsproject/atomate2/pull/1053 |
| 12 | +* `PhononMaker` add options to `calculate_pdos` and save force constants to file by @chouyoudou in https://github.com/materialsproject/atomate2/pull/1008 |
| 13 | +* Allow `MatPesStaticFlowMaker(static2=None)` by @janosh in https://github.com/materialsproject/atomate2/pull/997 |
| 14 | +### Documentation 📖 |
| 15 | +* Minor docs cleanup by @esoteric-ephemera in https://github.com/materialsproject/atomate2/pull/1047 |
| 16 | +* add openmm description to docs by @JaGeo in https://github.com/materialsproject/atomate2/pull/1069 |
| 17 | +* Docs update, forcefield elastic convenience maker, forcefield enum hydration by @esoteric-ephemera in https://github.com/materialsproject/atomate2/pull/1072 |
| 18 | +* Added the ChemRxiv citation by @hrushikesh-s in https://github.com/materialsproject/atomate2/pull/1107 |
| 19 | +* Fix docs by @janosh in https://github.com/materialsproject/atomate2/pull/1109 |
| 20 | +### House-Keeping 🧹 |
| 21 | +* Fix minor phonon code formatting issues + typos by @janosh in https://github.com/materialsproject/atomate2/pull/1070 |
| 22 | +* Fix bump phonopy by @naik-aakash in https://github.com/materialsproject/atomate2/pull/1006 |
| 23 | +* update calorine version by @naik-aakash in https://github.com/materialsproject/atomate2/pull/1083 |
| 24 | +* Deprecated `Structure.ntypesp` in pymatgen by @jmmshn in https://github.com/materialsproject/atomate2/pull/1105 |
| 25 | + |
| 26 | +### New Contributors |
| 27 | +* @chouyoudou made their first contribution in https://github.com/materialsproject/atomate2/pull/1008 |
| 28 | +* @VicTrqt made their first contribution in https://github.com/materialsproject/atomate2/pull/1108 |
| 29 | + |
| 30 | +**Full Changelog**: https://github.com/materialsproject/atomate2/compare/v0.0.18...v0.0.19 |
| 31 | + |
3 | 32 | ## v0.0.18
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4 | 33 |
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5 | 34 | ### New Features 🎉
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