update deps for testing - problem with openmpi 5.0

Author: bastonero

.github/workflows/ci.yml

@@ -121,7 +121,7 @@ jobs:
                     auto-activate-base: true
 
             -   name: Set up Quantum ESPRESSO
-                run: conda install -y qe pip aiida-core
+                run: conda install -y qe openmpi~=4.0 pip aiida-core
 
             -   name: Install Python dependencies
                 run: pip install -e .[tests]

environment.yml

@@ -2,7 +2,8 @@ channels:
   - conda-forge
 dependencies:
   - qe==7.5
-  - python=3.9
+  - openmpi~=4.0
+  - python=3.12
   - pip
   - aiida-core~=2.7
   - xmltodict