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Increment version after addition of ase.generate.neb.
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Also includes support for nested structure when you pass
ConfigSet.groups() as the inputs iterable.
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bernstei committed Mar 5, 2024
1 parent a20b355 commit bf887a6
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2 changes: 1 addition & 1 deletion setup.py
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setuptools.setup(
name="wfl",
version="0.2.2",
version="0.2.3",
packages=setuptools.find_packages(exclude=["tests"]),
install_requires=["click>=7.0", "numpy", "ase>=3.21", "pyyaml", "spglib", "docstring_parser",
"expyre-wfl @ https://github.com/libAtoms/ExPyRe/tarball/main",
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