pylammpsmpi 0.2.25

What's Changed

• Bump executorlib from 0.0.1 to 0.0.2 by @dependabot in #246

Full Changelog: pylammpsmpi-0.2.24...pylammpsmpi-0.2.25

pylammpsmpi-0.2.24

What's Changed

• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #233
• Revert to mpi4py 3.1.6 by @jan-janssen in #235
• Add executor test by @jan-janssen in #237
• Bump mpi4py from 3.1.6 to 4.0.0 by @dependabot in #236
• Use Github Co-pilot to add docstrings and type hints by @jan-janssen in #240
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #241
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #242
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #244
• Bump scipy from 1.14.0 to 1.14.1 by @dependabot in #245

Full Changelog: pylammpsmpi-0.2.23...pylammpsmpi-0.2.24

pylammpsmpi-0.2.23

What's Changed

• Update LAMMPS to 2024.06.27 by @jan-janssen in #231
• Bump mpi4py from 3.1.6 to 4.0.0 by @dependabot in #232

Full Changelog: pylammpsmpi-0.2.22...pylammpsmpi-0.2.23

pylammpsmpi 0.2.22

What's Changed

• Remove structure set by @jan-janssen in #227
• Add more tests by @jan-janssen in #228
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #229
• Remove UnfoldPrism by @jan-janssen in #230

Full Changelog: pylammpsmpi-0.2.21...pylammpsmpi-0.2.22

pylammpsmpi 0.2.21

What's Changed

• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #220
• Add import sorting to ruff by @jan-janssen in #221
• Update conda-incubator/setup-miniconda from v2 to v3 by @jan-janssen in #222
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #223
• Bump pympipool from 0.8.5 to 0.9.1 by @dependabot in #224
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #225

Full Changelog: pylammpsmpi-0.2.20...pylammpsmpi-0.2.21

pylammpsmpi 0.2.20

What's Changed

• Update ASE to 3.23.0 by @jan-janssen in #210
• Fix CI for stacked pull requests by @jan-janssen in #211
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #212
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #213
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #215
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #216
• Bump pympipool from 0.8.4 to 0.8.5 by @dependabot in #219
• Bump scipy from 1.13.1 to 1.14.0 by @dependabot in #217

Full Changelog: pylammpsmpi-0.2.19...pylammpsmpi-0.2.20

pylammpsmpi-0.2.19

What's Changed

• Fix coverage by @jan-janssen in #192
• Create CODEOWNERS by @jan-janssen in #193
• Bump pympipool from 0.8.0 to 0.8.1 by @dependabot in #194
• Add ASE test by @jan-janssen in #195
• Add timeout to coverage by @jan-janssen in #196
• Test ASE triclinic cell by @jan-janssen in #197
• More tests by @jan-janssen in #199
• Add two more tests for LAMMPS base by @jan-janssen in #200
• Bump pympipool from 0.8.1 to 0.8.2 by @dependabot in #202
• Add ruff formatter by @jan-janssen in #205
• Bump pympipool from 0.8.2 to 0.8.3 by @dependabot in #206
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #208
• Bump pympipool from 0.8.3 to 0.8.4 by @dependabot in #209
• Bump scipy from 1.13.0 to 1.13.1 by @dependabot in #207

New Contributors

• @pre-commit-ci made their first contribution in #208

Full Changelog: pylammpsmpi-0.2.18...pylammpsmpi-0.2.19

pylammpsmpi 0.2.18

What's Changed

• Update pympipool to 0.8.0 by @jan-janssen in #191

Full Changelog: pylammpsmpi-0.2.17...pylammpsmpi-0.2.18

pylammpsmpi 0.2.17

What's Changed

• Use Python 3.12 as default for Continuous Integration by @jan-janssen in #187
• Set upper limit for Python version by @jan-janssen in #189
• Bump pympipool from 0.7.17 to 0.7.18 by @dependabot in #190
• Bump mpi4py from 3.1.5 to 3.1.6 by @dependabot in #188

Full Changelog: pylammpsmpi-0.2.16...pylammpsmpi-0.2.17

pylammpsmpi 0.2.16

What's Changed

• Bump scipy from 1.12.0 to 1.13.0 by @dependabot in #183
• Update also the environment in binder/environment.yml by @jan-janssen in #185
• Update LAMMPS to 2024.02.07 by @jan-janssen in #184
• Merge main by @jan-janssen in #186
• Migration to Python 3.12 by @jan-janssen in #149

Full Changelog: pylammpsmpi-0.2.15...pylammpsmpi-0.2.16