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mbercxsphuber
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🔧 Pin abipy version
Due to the close dependency of `abipy` on `pymatgen`, and our own dependencies on `pymatgen`, it is challenging to install both packages in one environment. Version `0.9.6` of `abipy` was released after some specific changes were made to ensure it can install with our current `master` branch, which we intend to release for the oxide verification paper. Since it is highly likely that the next version of `abipy` will make changes to the code to update it for `pymatgen` versions we no longer support, we pin the version to this release.
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pyproject.toml

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@@ -22,7 +22,7 @@ classifiers = [
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keywords = ['aiida', 'workflows']
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requires-python = '>=3.8'
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dependencies = [
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'abipy',
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'abipy==0.9.6',
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'aiida-abinit~=0.4.0',
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'aiida-bigdft>=0.2.6',
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'aiida-castep>=1.2.0a5',

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