issues
search
pyiron
/
pylammpsmpi
Parallel Lammps Python interface - control a mpi4py parallel LAMMPS instance from a serial python process or a Jupyter notebook
https://pylammpsmpi.readthedocs.io
BSD 3-Clause "New" or "Revised" License
30
stars
4
forks
source link
issues
Newest
Newest
Most commented
Recently updated
Oldest
Least commented
Least recently updated
Update pympipool to 0.8.5
#218
jan-janssen
closed
5 months ago
1
Bump scipy from 1.13.1 to 1.14.0
#217
dependabot[bot]
closed
5 months ago
2
[pre-commit.ci] pre-commit autoupdate
#216
pre-commit-ci[bot]
closed
5 months ago
1
[pre-commit.ci] pre-commit autoupdate
#215
pre-commit-ci[bot]
closed
5 months ago
1
Bump numpy from 1.26.4 to 2.0.0
#214
dependabot[bot]
closed
4 months ago
2
[pre-commit.ci] pre-commit autoupdate
#213
pre-commit-ci[bot]
closed
5 months ago
2
[pre-commit.ci] pre-commit autoupdate
#212
pre-commit-ci[bot]
closed
5 months ago
1
Fix CI for stacked pull requests
#211
jan-janssen
closed
5 months ago
1
Update ASE to 3.23.0
#210
jan-janssen
closed
6 months ago
1
Bump pympipool from 0.8.3 to 0.8.4
#209
dependabot[bot]
closed
6 months ago
1
[pre-commit.ci] pre-commit autoupdate
#208
pre-commit-ci[bot]
closed
6 months ago
1
Bump scipy from 1.13.0 to 1.13.1
#207
dependabot[bot]
closed
6 months ago
2
Bump pympipool from 0.8.2 to 0.8.3
#206
dependabot[bot]
closed
6 months ago
1
Add ruff formatter
#205
jan-janssen
closed
6 months ago
1
merge main
#204
jan-janssen
closed
6 months ago
1
Allow switching between MPI and srun as backends
#203
jan-janssen
opened
6 months ago
1
Bump pympipool from 0.8.1 to 0.8.2
#202
dependabot[bot]
closed
6 months ago
2
[Feature] leverage triclinic cell support in LAMMPS
#201
jan-janssen
opened
6 months ago
0
Add two more tests for LAMMPS base
#200
jan-janssen
closed
7 months ago
0
More tests
#199
jan-janssen
closed
7 months ago
0
[Code quality] It would be great to increase the test coverage
#198
jan-janssen
opened
7 months ago
0
Test ASE triclinic cell
#197
jan-janssen
closed
7 months ago
0
Add timeout to coverage
#196
jan-janssen
closed
7 months ago
0
Add ASE test
#195
jan-janssen
closed
7 months ago
0
Bump pympipool from 0.8.0 to 0.8.1
#194
dependabot[bot]
closed
7 months ago
1
Create CODEOWNERS
#193
jan-janssen
closed
7 months ago
0
Fix coverage
#192
jan-janssen
closed
7 months ago
0
Update pympipool to 0.8.0
#191
jan-janssen
closed
7 months ago
0
Bump pympipool from 0.7.17 to 0.7.18
#190
dependabot[bot]
closed
7 months ago
1
Set upper limit for Python version
#189
jan-janssen
closed
7 months ago
0
Bump mpi4py from 3.1.5 to 3.1.6
#188
dependabot[bot]
closed
7 months ago
0
Use Python 3.12 as default for Continuous Integration
#187
jan-janssen
closed
7 months ago
0
Merge main
#186
jan-janssen
closed
7 months ago
0
Update also the environment in binder/environment.yml
#185
jan-janssen
closed
7 months ago
0
Update LAMMPS to 2024.02.07
#184
jan-janssen
closed
7 months ago
0
Bump scipy from 1.12.0 to 1.13.0
#183
dependabot[bot]
closed
7 months ago
2
Update pympipool to 0.7.17
#182
jan-janssen
closed
9 months ago
0
Call python executable via sys.executable
#181
jan-janssen
closed
9 months ago
0
Bump pympipool from 0.7.14 to 0.7.15
#180
dependabot[bot]
closed
9 months ago
0
Bump pympipool from 0.7.13 to 0.7.14
#179
dependabot[bot]
closed
9 months ago
0
Fix coverage
#178
jan-janssen
closed
9 months ago
0
Add sleep interval parameter
#177
jan-janssen
closed
9 months ago
0
LammpsLibrary hangs on close
#176
pmrv
opened
9 months ago
12
Bump pympipool from 0.7.11 to 0.7.13
#175
dependabot[bot]
closed
9 months ago
1
Switch dependabot to daily
#174
jan-janssen
closed
9 months ago
0
Bump numpy from 1.26.3 to 1.26.4
#173
dependabot[bot]
closed
9 months ago
1
Update LAMMPS to 2023.11.21
#172
jan-janssen
closed
10 months ago
0
update pympipool to 0.7.11
#171
jan-janssen
closed
10 months ago
0
Bump scipy from 1.11.4 to 1.12.0
#170
dependabot[bot]
closed
10 months ago
0
Delete .github/delete-merged-branch-config.yml
#169
jan-janssen
closed
10 months ago
0
Previous
Next