pip install BoltzTraP2

materialsproject · Sep 23, 2024 · 018f644 · 018f644
1 parent 60464fd
commit 018f644
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Showing 2 changed files with 2 additions and 7 deletions.
diff --git a/.github/workflows/test.yml b/.github/workflows/test.yml
@@ -91,10 +91,6 @@ jobs:
         run: |
           micromamba activate pmg
 
-          # TODO: uv cannot install BoltzTraP2 at this moment,
-          # track https://gitlab.com/sousaw/BoltzTraP2/-/merge_requests/21
-          pip install BoltzTraP2
-
           # Install BoltzTraP
           wget -q -O BoltzTraP.tar.bz2 https://owncloud.tuwien.ac.at/index.php/s/s2d55LYlZnioa3s/download
           tar -jxf BoltzTraP.tar.bz2

diff --git a/pyproject.toml b/pyproject.toml
@@ -101,9 +101,8 @@ docs = ["invoke", "sphinx", "sphinx_markdown_builder", "sphinx_rtd_theme"]
 optional = [
     "ase>=3.23.0",
     "beautifulsoup4",
-    # TODO: uv cannot install BoltzTraP2 at this moment
-    # track https://gitlab.com/sousaw/BoltzTraP2/-/merge_requests/21
-    # "BoltzTraP2>=24.7.2 ; platform_system != 'Windows'",
+    # TODO: why exclude windows for BoltzTraP2?
+    "BoltzTraP2>=24.9.1 ; platform_system != 'Windows'",
     "chemview>=0.6",
     "chgnet>=0.3.8",
     "f90nml>=1.1.2",