Merge pull request #30 from openkim/devel

Update version to be compatible with kim-api 2.4.0

Author: mjwen

.github/workflows/publish.yml

@@ -12,7 +12,7 @@ jobs:
       - uses: actions/checkout@v4
 
       - name: Set up micromamba
-        uses: mamba-org/setup-micromamba@v1.8.1
+        uses: mamba-org/setup-micromamba@v2
         with:
           # the create command looks like this:
           # `micromamba create -n test-env python=<the corresponding version>`

.github/workflows/testing.yml

@@ -7,14 +7,14 @@ jobs:
     strategy:
       matrix:
         os: [ubuntu-latest, macos-latest]
-        python-version: ["3.8", "3.9", "3.10"]
+        python-version: ["3.9", "3.10", "3.11"]
 
     runs-on: ${{ matrix.os }}
 
     steps:
       - uses: actions/checkout@v4
       - name: Set up micromamba
-        uses: mamba-org/setup-micromamba@v1.8.1
+        uses: mamba-org/setup-micromamba@v2
         with:
           # the create command looks like this:
           # `micromamba create -n test-env python=<the corresponding version>`

api_compatibility.txt

@@ -26,3 +26,4 @@
   2.0.1          2.3.0               2.2.1
   2.1.0          2.3.0               2.2.1
   2.1.1          2.3.0               2.2.1
+  2.1.2          2.4.0               2.2.1

kimpy/__init__.py

@@ -1,4 +1,4 @@
-__version__ = "2.1.1"
+__version__ = "2.1.2"
 
 # import all modules
 from . import model

setup.py

@@ -309,7 +309,8 @@ def chech_kim_api_compatibility():
     name="kimpy",
     version=get_kimpy_version(),
     packages=find_packages(),
-    install_requires=["numpy"],
+    setup_requires=["pybind11"],
+    install_requires=["numpy", "pybind11"],
     extras_require={
         "test": ["pytest", "ase"],
     },