Merge branch 'master' into type-elec-struct

Author: DanielYang59

.editorconfig

@@ -0,0 +1,22 @@
+# top-most EditorConfig file
+root = true
+
+# Unix-style newlines with a newline ending every file
+[*]
+end_of_line = lf
+insert_final_newline = true
+
+# Matches multiple files with brace expansion notation
+# Set default charset
+[*.py]
+charset = utf-8
+
+# 4 space indentation
+[*.py]
+indent_style = space
+indent_size = 4
+
+# Matches the exact files either package.json or .travis.yml
+[{*.{json,yml,yaml}]
+indent_style = space
+indent_size = 2

.github/workflows/test.yml

@@ -77,7 +77,7 @@ jobs:
           micromamba activate pmg
           # TODO remove temporary fix. added since uv install torch is flaky.
           # track https://github.com/astral-sh/uv/issues/1921 for resolution
-          pip install torch
+          pip install torch --upgrade
 
           uv pip install numpy cython
           uv pip install --editable '.[${{ matrix.config.extras }}]' --resolution=${{ matrix.config.resolution }}

pyproject.toml

@@ -60,7 +60,8 @@ dependencies = [
     "matplotlib>=3.8",
     "monty>=2024.5.24",
     "networkx>=2.2",
-    "numpy>=1.25.0,<2.0.0",
+    'numpy>=1.25.0,<2.0 ; platform_system == "Windows"',
+    'numpy>=1.25.0 ; platform_system != "Windows"',
     "palettable>=3.1.1",
     "pandas>=2",
     "plotly>=4.5.0",