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Install some optional dependencies in CI (#3786)
* enable `boltztrap2` * Revert "enable `boltztrap2`" This reverts commit 3b1b077. * use explicit encoding * install graphviz * increment boltztrap version to 24.1.1 * fix bader patch * pre-commit auto-fixes * ruff fix * tweak bader test * need confirm: add `wheel` to dev dep * try install BoltzTraP2 with pip * add comment * try move bolt after numpy to fix win, remove wheel * try move boltrap2 to ubuntu only * more description more accurate * install BoltzTraP2 in CI * try to install BoltzTraP2 with uv * remove repeated numpy install in CI tests * update np.exceptions.RankWarning * Revert "update np.exceptions.RankWarning" This reverts commit 4128284. * install setuptool with uv * update BoltzTraP2 * install wheel for building boltztrap2 * try to install boltztrap2 with pip not uv * install cython before boltztrap2 * try to install boltztrap2 with optional * try to manually install bt2 in workflow * manually install bt2 with pip * remove bt2 ver * install bt2 only on ubuntu * skip bt2 for windows * try to fix failing bt2 test * more descriptive skip msg * finish typing of bzt2 * try to install pygraphviz * revert update to | replace for graphs * test.yml join install pymatgen and install dependencies steps * fix TestStructureGraph.test_draw unhashable type list error * skip BoltzTraP2 and matplotlib 3.9.1 --------- Co-authored-by: Janosh Riebesell <[email protected]>
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