Merge pull request #157 from pyiron/pympipool

Update pympipool to 0.7.5

Author: jan-janssen

.ci_support/environment-mpich.yml

@@ -6,6 +6,6 @@ dependencies:
   - mpich
   - numpy =1.26.0
   - mpi4py =3.1.5
-  - pympipool =0.7.3
+  - pympipool =0.7.5
   - ase =3.22.1
   - scipy =1.11.3

.ci_support/environment-openmpi.yml

@@ -6,6 +6,6 @@ dependencies:
   - openmpi
   - numpy =1.26.0
   - mpi4py =3.1.5
-  - pympipool =0.7.3
+  - pympipool =0.7.5
   - ase =3.22.1
   - scipy =1.11.3

binder/environment.yml

@@ -2,9 +2,9 @@ channels:
 - conda-forge
 dependencies:
 - openmpi
-- numpy =1.23.5
-- lammps >=2021.05.27
-- mpi4py =3.1.4
-- pympipool =0.5.6
+- numpy =1.26.0
+- lammps =2023.08.02
+- mpi4py =3.1.5
+- pympipool =0.7.5
 - ase =3.22.1
-- scipy =1.10.1
+- scipy =1.11.3

setup.py

@@ -27,7 +27,7 @@
     keywords='lammps, mpi4py',
     packages=find_packages(exclude=["*tests*"]),
     install_requires=[
-        "mpi4py==3.1.5", "pympipool==0.7.3", "numpy==1.26.0"
+        "mpi4py==3.1.5", "pympipool==0.7.5", "numpy==1.26.0"
     ],
     extras_require={
         "ase": ["ase==3.22.1", "scipy==1.11.3"],