pyiron_atomistics 0.4.6

What's Changed

• Fix integration notebooks by @jan-janssen in #1291

Full Changelog: pyiron_atomistics-0.4.5...pyiron_atomistics-0.4.6

pyiron_atomistics 0.4.5

What's Changed

• Bump mp-api from 0.39.4 to 0.39.5 by @dependabot in #1285
• Update pyiron_base to 0.6.21 by @jan-janssen in #1287
• Delete .github/delete-merged-branch-config.yml by @jan-janssen in #1290

Full Changelog: pyiron_atomistics-0.4.4...pyiron_atomistics-0.4.5

pyiron_atomistics 0.4.4

What's Changed

• Update numpy to 1.26.3 by @jan-janssen in #1283

Full Changelog: pyiron_atomistics-0.4.3...pyiron_atomistics-0.4.4

pyiron_atomistics 0.4.3

What's Changed

• Update pyiron_base to 0.6.19 by @jan-janssen in #1282

Full Changelog: pyiron_atomistics-0.4.2...pyiron_atomistics-0.4.3

pyiron_atomistics 0.4.2

What's Changed

• Fix lower bound for pyiron_base by @jan-janssen in #1268
• Update pyiron_base to 0.6.15 by @jan-janssen in #1269
• Lammps: use to_dict() rather than to_hdf() by @jan-janssen in #1271
• Bump atomistics from 0.1.18 to 0.1.19 by @dependabot in #1276
• Bump mendeleev from 0.14.0 to 0.15.0 by @dependabot in #1275
• [minor] Simplify SPHInX input by @samwaseda in #1277
• Update pyiron_base to 0.6.17 by @jan-janssen in #1278
• Fix coverage for main by @jan-janssen in #1279
• Update pyiron_base to 0.6.18 by @jan-janssen in #1280
• Update Structuretoolkit to 0.0.16 by @jan-janssen in #1281

Full Changelog: pyiron_atomistics-0.4.1...pyiron_atomistics-0.4.2

pyiron_atomistics-0.4.1

What's Changed

• Purge SerialMaster by @pmrv in #1266
• Upgrade pyiron_base to 0.6.14 by @jan-janssen in #1265
• Do not use .project_hdf5 by @pmrv in #1267

Full Changelog: pyiron_atomistics-0.4.0...pyiron_atomistics-0.4.1

pyiron_atomistics 0.3.12

What's Changed

• merge main by @jan-janssen in #1236
• Bump atomistics from 0.1.12 to 0.1.14 by @dependabot in #1255
• Bump pylammpsmpi from 0.2.9 to 0.2.10 by @dependabot in #1259
• Bump mp-api from 0.39.1 to 0.39.4 by @dependabot in #1254
• make a file for sphinx parsers by @samwaseda in #1230
• Fix lammps parser by @samwaseda in #1261
• Bump atomistics from 0.1.14 to 0.1.16 by @dependabot in #1263
• Bump pyiron-base from 0.6.12 to 0.6.13 by @dependabot in #1262
• Bump pandas from 2.1.3 to 2.1.4 by @dependabot in #1257
• Bump spglib from 2.1.0 to 2.2.0 by @dependabot in #1256
• Bump pint from 0.22 to 0.23 by @dependabot in #1258

Full Changelog: pyiron_atomistics-0.3.11...pyiron_atomistics-0.3.12

pyiron_atomistics-0.3.11

What's Changed

• Bump mp-api from 0.39.0 to 0.39.1 by @dependabot in #1246
• Bump phonopy from 2.20.0 to 2.21.0 by @dependabot in #1245
• specify mininmum dimension for output values by @samwaseda in #1234
• Fix init - to report the correct version by @jan-janssen in #1248
• Bump pyiron_base from 0.6.11 to 0.6.12 by @pmrv in #1252

Full Changelog: pyiron_atomistics-0.3.10...pyiron_atomistics-0.3.11

pyiron_atomistics 0.3.9

What's Changed

• Add gpaw as dependency for integration tests by @jan-janssen in #1237
• update pyiron_base by @jan-janssen in #1238
• Use coveralls action by @jan-janssen in #1239
• Test Lower bounds by @jan-janssen in #1240
• Test older version of matplotlib by @jan-janssen in #1241
• Switch from setup.py to pyproject.toml by @jan-janssen in #1242

Full Changelog: pyiron_atomistics-0.3.8...pyiron_atomistics-0.3.9

pyiron_atomistics 0.3.10

What's Changed

• fix release script by @jan-janssen in #1244
• add matplotlib to conda pypi conversion by @jan-janssen in #1243

Full Changelog: pyiron_atomistics-0.3.9...pyiron_atomistics-0.3.10