pyiron_atomistics 0.4.11

What's Changed

• Update pyiron_base to 0.7.3 by @jan-janssen in #1306

Full Changelog: pyiron_atomistics-0.4.10...pyiron_atomistics-0.4.11

pyiron_atomistics 0.4.10

What's Changed

• Lammps: Only try to use restart file when present by @pmrv in #1289
• A workaround to fix reloading potentials with LAMMPS by @jan-janssen in #1304

Full Changelog: pyiron_atomistics-0.4.9...pyiron_atomistics-0.4.10

pyiron_atomistics 0.4.9

What's Changed

• Spx add tests by @skatnagallu in #1250
• Separate input writer from pyiron by @samwaseda in #1270
• Issues from the Austrian-German workshop by @niklassiemer in #1294
• Update scikit-learn to 1.4.0 by @jan-janssen in #1295
• Bump pandas from 2.1.4 to 2.2.0 by @dependabot in #1296
• Merge main by @jan-janssen in #1298
• Bump scipy from 1.11.4 to 1.12.0 by @dependabot in #1297
• [minor] Separate update functions in Quasi Newton by @samwaseda in #1299
• Parser for waves.sxb files from SPHInX by @skatnagallu in #1224
• Bump spglib from 2.2.0 to 2.3.0 by @dependabot in #1300

Full Changelog: pyiron_atomistics-0.4.7...pyiron_atomistics-0.4.9

pyiron_atomistics 0.4.7

What's Changed

• fix coverage by @jan-janssen in #1292
• Update pyironb base to 0.7.0 by @jan-janssen in #1293

Full Changelog: pyiron_atomistics-0.4.6...pyiron_atomistics-0.4.7

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