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installing phono3py using conda
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hrushikesh-s committed Nov 22, 2024
1 parent cc12b08 commit 8f6b299
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1 change: 1 addition & 0 deletions .github/workflows/testing.yml
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Expand Up @@ -67,6 +67,7 @@ jobs:
mkdir -p ~/.abinit/pseudos
cp -r tests/test_data/abinit/pseudos/ONCVPSP-PBE-SR-PDv0.4 ~/.abinit/pseudos
uv pip install .[strict,strict-forcefields,tests,abinit]
micromamba install -n a2 -c conda-forge phono3py --yes # Added
uv pip install torch-runstats
uv pip install --no-deps nequip==0.5.6
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1 change: 0 additions & 1 deletion pyproject.toml
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Expand Up @@ -130,7 +130,6 @@ strict = [
"hiphive @ git+https://gitlab.com/jsyony37/hiphive.git@personal#egg=hiphive",
"f90nml==1.4.4",
"spglib>=2.2.0",
"phono3py",
"scipy==1.14.1",
]
strict-forcefields = [
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