Fix for abinp.py vasp

.github/workflows/gh-pages.yml

@@ -62,7 +62,7 @@ jobs:
             cp abipy/data/managers/gh_manager.yml $HOME/.abinit/abipy/manager.yml
             cp abipy/data/managers/gh_scheduler.yml $HOME/.abinit/abipy/scheduler.yml
             # FIXME TEMPORARY HACK
-            pip install git+https://github.com/gmatteo/pymatgen.git@master -U
+            #pip install git+https://github.com/gmatteo/pymatgen.git@master -U
 
       - name: Build docs with Sphinx
         run: |
@@ -74,7 +74,7 @@ jobs:
       - name: Upload artifact
         uses: actions/upload-pages-artifact@v2
         with:
-          path: site/ # Important. Set to your output dir in MkDocs
+          path: _build/html/ # Important. Set to the website output dir
 
   deploy:
     environment:

.github/workflows/test.yml

@@ -19,15 +19,15 @@ jobs:
       run:
         shell: bash -l {0} # enables conda/mamba env activation by reading bash profile
 
-    strategy:
-      fail-fast: false
-      matrix:
-        config:
-          - os: ubuntu-latest
-            python: '3.11'
-        config:
-          - os: ubuntu-latest
-            python: '3.12'
+    #strategy:
+    #  fail-fast: false
+    #  matrix:
+    #    config:
+    #      - os: ubuntu-latest
+    #        python: '3.11'
+    #    config:
+    #      - os: ubuntu-latest
+    #        python: '3.12'
 
     runs-on: ${{ matrix.config.os }}
     env:

abipy/scripts/abinp.py

@@ -14,33 +14,33 @@
 from typing import Type
 from monty.termcolor import cprint
 from monty.functools import prof_main
-from pymatgen.io.vasp.sets import DictSet
+from pymatgen.io.vasp.sets import VaspInputSet
 from abipy import abilab
 from abipy.abio import factories
 from abipy.abio.inputs import AnaddbInput
 from abipy.dfpt.ddb import DdbFile
 
 
-def vasp_dict_set_cls(s: str | DictSet) -> Type | list[str]:
+def vasp_dict_set_cls(s: str | VaspInputSet) -> Type | list[str]:
     """
     Return a subclass of DictSect from string `s`.
-    If s == "__all__", return list with all DictSet subclasses supported by pymatgen.
+    If s == "__all__", return list with all VaspInputSet subclasses supported by pymatgen.
     """
     from inspect import isclass
     from pymatgen.io.vasp import sets
     def is_dict_set(key: str) -> bool:
-        return isclass(obj := getattr(sets, key)) and issubclass(obj, DictSet)
+        return isclass(obj := getattr(sets, key)) and issubclass(obj, VaspInputSet)
 
     valid_keys = [key for key in dir(sets) if is_dict_set(key)]
 
     if s == "__all__":
         return valid_keys
 
-    if isinstance(s, DictSet):
+    if isinstance(s, VaspInputSet):
         return s
 
     if s not in valid_keys:
-        raise ValueError(f"Unknown DictSet {s}, must be one of {valid_keys}")
+        raise ValueError(f"Unknown VaspInputSet {s}, must be one of {valid_keys}")
 
     return getattr(sets, s)