Merge branch 'main' into quayio

Author: niklassiemer

.github/workflows/weekly.yml

@@ -16,7 +16,7 @@ jobs:
     strategy:
       matrix:
         operating-system: [ubuntu-latest]
-        python-version: ["3.12"]
+        python-version: ["3.11"]
 
     steps:
     - uses: actions/checkout@v2

mpie_cmti/environment.yml

@@ -22,7 +22,7 @@ dependencies:
 - netcdf4 =1.7.2
 - nglview =3.1.4
 - mkl =2023.2.0
-- mlip =2.0
+- mlip =3.0
 - numba =0.60.0
 - openkim-models =2021.01.28
 - psycopg2 =2.9.9