Fix uv pip install from binary distribution (wheels) usage (#4210)

* fix uv pip install from bdist usage

* use uv to build wheels

* add single quote for macos

* add single quote for macos

* try ATAT3 install, it should fail

* Revert "try ATAT3 install, it should fail"

This reverts commit 3f63f4b.

* modest verbose level

* use mamba native env name and py ver

Author: DanielYang59

.github/workflows/test.yml

@@ -61,36 +61,34 @@ jobs:
       - name: Check out repo
         uses: actions/checkout@v4
 
-      - name: Set up micromamba
-        uses: mamba-org/setup-micromamba@main
-
       - name: Create mamba environment
-        run: |
-          micromamba create -n pmg python=${{ matrix.config.python }} --yes
+        uses: mamba-org/setup-micromamba@main
+        with:
+          environment-name: pmg
+          create-args: >-
+            python=${{ matrix.config.python }}
 
       - name: Install ubuntu-only conda dependencies
         if: matrix.config.os == 'ubuntu-latest'
         run: |
           micromamba install -n pmg -c conda-forge bader enumlib \
             openff-toolkit packmol pygraphviz tblite --yes
 
+      - name: Install uv
+        uses: astral-sh/setup-uv@v4
+
       - name: Install pymatgen and dependencies via uv
         run: |
           micromamba activate pmg
-
-          pip install uv
-
           # TODO1 (use uv over pip) uv install torch is flaky, track #3826
           # TODO2 (pin torch version): DGL library (matgl) doesn't support torch > 2.2.1,
           # see: https://discuss.dgl.ai/t/filenotfounderror-cannot-find-dgl-c-graphbolt-library/4302
           pip install torch==2.2.1
 
           # Install from wheels to test the content
-          uv pip install build
-          python -m build --wheel
-
-          uv pip install dist/*.whl
-          uv pip install pymatgen[${{ matrix.config.extras }}] --resolution=${{ matrix.config.resolution }}
+          uv build --wheel --no-build-logs
+          WHEEL_FILE=$(ls dist/pymatgen*.whl)
+          uv pip install $WHEEL_FILE[${{matrix.config.extras}}] --resolution=${{matrix.config.resolution}}
 
       - name: Install optional Ubuntu dependencies
         if: matrix.config.os == 'ubuntu-latest'