Pyiron-gpl

What's Changed
* Bump scipy from 1.11.3 to 1.11.4 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/155
* Bump numpy from 1.26.0 to 1.26.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/156
* Bump pyiron-atomistics from 0.3.6 to 0.3.7 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/157
* Bump pyiron-atomistics from 0.3.7 to 0.3.10 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/158
* Bump pyiron-atomistics from 0.3.10 to 0.3.12 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/161
* Bump spglib from 2.1.0 to 2.2.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/159
* Bump pyiron-atomistics from 0.3.12 to 0.4.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/162
* Update pyiron_atomistics to 0.4.4 by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/163
* Delete .github/delete-merged-branch-config.yml by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/164
* Bump pyiron-atomistics from 0.4.4 to 0.4.6 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/165
* Pin maggma =0.60.2 rather than mp-api by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/166
* Bump scipy from 1.11.4 to 1.12.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/168
* Bump spglib from 2.2.0 to 2.3.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/169
* Bump pyiron-atomistics from 0.4.9 to 0.4.12 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/170
* Bump pyiron-atomistics from 0.4.12 to 0.4.14 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/172
* Bump pyiron-atomistics from 0.4.14 to 0.4.15 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/174
* Bump pyiron-atomistics from 0.4.15 to 0.4.17 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/175
* Update pyiron_atomistics to 0.5.0 by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/178
* Update coverage action by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/179
* Flatten test directory by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/180
* Use elastic from atomistics by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/177


**Full Changelog**: https://github.com/pyiron/pyiron_gpl/compare/pyiron_gpl-0.0.4...pyiron_gpl-0.0.5

What's Changed
* Bump pyiron-atomistics from 0.2.8 to 0.2.9 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/17
* Use DataContainer instead of deprecated InputList by liamhuber in https://github.com/pyiron/pyiron_gpl/pull/18
* Bump scipy from 1.6.1 to 1.6.2 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/19
* Bump numpy from 1.20.1 to 1.20.2 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/20
* Bump pyiron-atomistics from 0.2.9 to 0.2.10 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/21
* Bump pyiron-atomistics from 0.2.10 to 0.2.11 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/22
* Bump scipy from 1.6.2 to 1.6.3 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/23
* Upgrade to GitHub-native Dependabot by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/24
* weekly dependency updates by max-hassani in https://github.com/pyiron/pyiron_gpl/pull/25
* Bump pyiron-atomistics from 0.2.11 to 0.2.12 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/26
* Bump numpy from 1.20.2 to 1.20.3 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/27
* Bump pyiron-atomistics from 0.2.12 to 0.2.14 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/29
* Create .coveragerc by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/30
* Bump pyiron-atomistics from 0.2.14 to 0.2.15 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/31
* Bump pyiron-atomistics from 0.2.15 to 0.2.16 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/32
* Bump scipy from 1.6.3 to 1.7.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/33
* Bump numpy from 1.20.3 to 1.21.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/35
* Bump pyiron-atomistics from 0.2.16 to 0.2.17 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/34
* Bump pyiron-atomistics from 0.2.17 to 0.2.18 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/36
* Merge master by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/38
* Create .gitignore by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/39
* Create UpdateDependabotPR.yml by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/37
* Bump numpy from 1.21.0 to 1.21.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/41
* Bump pyiron-atomistics from 0.2.19 to 0.2.20 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/40
* Update workflow for dependabot PRs by niklassiemer in https://github.com/pyiron/pyiron_gpl/pull/42
* Bump pyiron-atomistics from 0.2.20 to 0.2.21 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/43
* Use mamba to accelerate CI by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/44
* Bump pyiron-atomistics from 0.2.21 to 0.2.22 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/46
* Bump scipy from 1.7.0 to 1.7.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/45
* Bump spglib from 1.16.1 to 1.16.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/47
* Bump numpy from 1.21.1 to 1.21.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/48
* Bump pyiron-atomistics from 0.2.22 to 0.2.23 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/49
* Bump pyiron-atomistics from 0.2.23 to 0.2.24 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/50
* Bump pyiron-atomistics from 0.2.24 to 0.2.25 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/51
* Bump pyiron-atomistics from 0.2.25 to 0.2.26 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/52
* Bump pyiron-atomistics from 0.2.26 to 0.2.27 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/53
* Bump numpy from 1.21.2 to 1.21.3 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/55
* Bump pyiron-atomistics from 0.2.27 to 0.2.28 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/54
* Bump pyiron-atomistics from 0.2.28 to 0.2.29 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/58
* Bump numpy from 1.21.3 to 1.21.4 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/57
* Use state instead of Settings by liamhuber in https://github.com/pyiron/pyiron_gpl/pull/59
* Bump scipy from 1.7.1 to 1.7.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/56
* Bump scipy from 1.7.2 to 1.7.3 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/60
* Bump pyiron-atomistics from 0.2.29 to 0.2.30 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/61
* Switch to python 3.10 by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/62
* Bump pyiron-atomistics from 0.2.30 to 0.2.31 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/63
* Bump pyiron-atomistics from 0.2.31 to 0.2.32 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/64
* Bump spglib from 1.16.2 to 1.16.3 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/65
* Bump pyiron-atomistics from 0.2.32 to 0.2.33 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/66
* Bump numpy from 1.21.4 to 1.21.5 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/67
* Bump numpy from 1.21.5 to 1.22.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/68
* Bump pyiron-atomistics from 0.2.33 to 0.2.34 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/69
* Bump pyiron-atomistics from 0.2.34 to 0.2.35 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/71
* Bump numpy from 1.22.0 to 1.22.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/70
* Bump numpy from 1.22.1 to 1.22.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/74
* Bump pyiron-atomistics from 0.2.35 to 0.2.36 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/72
* Bump scipy from 1.7.3 to 1.8.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/73
* Bump pyiron-atomistics from 0.2.36 to 0.2.37 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/75
* Bump pyiron-atomistics from 0.2.37 to 0.2.38 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/76
* Bump pyiron-atomistics from 0.2.38 to 0.2.39 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/77
* Bump pyiron-atomistics from 0.2.39 to 0.2.40 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/78
* Bump numpy from 1.22.2 to 1.22.3 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/79
* Bump pyiron-atomistics from 0.2.40 to 0.2.41 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/80
* Bump pyiron-atomistics from 0.2.41 to 0.2.42 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/81
* Bump pyiron-atomistics from 0.2.42 to 0.2.43 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/82
* Bump pyiron-atomistics from 0.2.43 to 0.2.44 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/83
* Bump pyiron-atomistics from 0.2.44 to 0.2.45 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/84
* Bump spglib from 1.16.3 to 1.16.5 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/85
* Bump scipy from 1.8.0 to 1.8.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/87
* Bump numpy from 1.22.3 to 1.22.4 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/86
* remove PaceMakerJob from pyiron_gpl repo (it is moved into pyiron_contrib) by yury-lysogorskiy in https://github.com/pyiron/pyiron_gpl/pull/88
* Bump pyiron-atomistics from 0.2.45 to 0.2.47 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/89
* Bump numpy from 1.22.4 to 1.23.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/91
* Bump pyiron-atomistics from 0.2.47 to 0.2.48 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/90
* Bump numpy from 1.23.0 to 1.23.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/93
* Bump pyiron-atomistics from 0.2.48 to 0.2.49 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/92
* Bump pyiron-atomistics from 0.2.49 to 0.2.50 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/94
* Bump pyiron-atomistics from 0.2.50 to 0.2.51 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/95
* Bump spglib from 1.16.5 to 2.0.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/101
* Bump numpy from 1.23.1 to 1.23.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/99
* Bump spglib from 2.0.0 to 2.0.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/103
* Bump numpy from 1.23.2 to 1.23.3 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/105
* Bump numpy from 1.23.3 to 1.23.4 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/109
* Bump spglib from 2.0.1 to 2.0.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/113
* Bump numpy from 1.23.4 to 1.23.5 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/114
* Update branch referenced by liamhuber in https://github.com/pyiron/pyiron_gpl/pull/116
* Bump scipy from 1.8.1 to 1.9.3 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/111
* Bump scipy from 1.9.3 to 1.10.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/120
* Bump numpy from 1.23.5 to 1.24.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/119
* Merge with main by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/122
* Build with Python 3.11 by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/121
* Update conda environment by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/123
* Bump numpy from 1.24.1 to 1.24.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/124
* Bump scipy from 1.10.0 to 1.10.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/125
* Bump pyiron-atomistics from 0.2.62 to 0.2.65 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/128
* Bump numpy from 1.24.2 to 1.24.3 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/130
* Bump pyiron-atomistics from 0.2.65 to 0.2.66 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/129
* Bump pyiron-atomistics from 0.2.66 to 0.2.67 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/131
* Update UpdateDependabotPR.yml by niklassiemer in https://github.com/pyiron/pyiron_gpl/pull/132
* Bump scipy from 1.10.1 to 1.11.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/136
* Bump pyiron-atomistics from 0.2.67 to 0.3.1 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/138
* Bump scipy from 1.11.1 to 1.11.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/139
* Bump pyiron-atomistics from 0.3.1 to 0.3.2 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/140
* Bump spglib from 2.0.2 to 2.1.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/142
* Bump pyiron-atomistics from 0.3.2 to 0.3.3 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/144
* Bump numpy from 1.24.3 to 1.26.0 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/143
* Merge main by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/149
* versioneer update to 0.29 by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/147
* Bump pyiron-atomistics from 0.3.4 to 0.3.5 by dependabot in https://github.com/pyiron/pyiron_gpl/pull/152
* Update pyiron_atomistics to 0.3.6 by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/154
* Use trusted publisher action by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/153

New Contributors
* liamhuber made their first contribution in https://github.com/pyiron/pyiron_gpl/pull/18
* max-hassani made their first contribution in https://github.com/pyiron/pyiron_gpl/pull/25
* dependabot made their first contribution in https://github.com/pyiron/pyiron_gpl/pull/26
* niklassiemer made their first contribution in https://github.com/pyiron/pyiron_gpl/pull/42

**Full Changelog**: https://github.com/pyiron/pyiron_gpl/compare/pyiron_gpl-0.0.3...pyiron_gpl-0.0.4

What's Changed
* Bump pyiron-atomistics from 0.2.4 to 0.2.5 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/8
* Enable delete branch by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/9
* Bump pyiron-atomistics from 0.2.5 to 0.2.6 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/10
* Bump pyiron-atomistics from 0.2.6 to 0.2.7 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/11
* Bump scipy from 1.6.0 to 1.6.1 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/4
* Migrate quickff and yaff to pyiron_gpl by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/7
* Check pypi status with pip check by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/12
* Remove sqlalchemy restriction by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/13
* Bump scipy from 1.6.0 to 1.6.1 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/14
* merge by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/16
* Bump pyiron-atomistics from 0.2.7 to 0.2.8 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/15


**Full Changelog**: https://github.com/pyiron/pyiron_gpl/compare/pyiron_gpl-0.0.2...pyiron_gpl-0.0.3

What's Changed
* Add code of conduct by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/1
* Update requirements by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/2
* Bump pyiron-atomistics from 0.2.3 to 0.2.4 by dependabot-preview in https://github.com/pyiron/pyiron_gpl/pull/5
* Merge with master by jan-janssen in https://github.com/pyiron/pyiron_gpl/pull/6
* Feature/pacemaker interface by yury-lysogorskiy in https://github.com/pyiron/pyiron_gpl/pull/3


**Full Changelog**: https://github.com/pyiron/pyiron_gpl/commits/pyiron_gpl-0.0.2