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Merge pull request #192 from WMD-group/new_release-2.5.5
Preparing new release 2.5.5
2 parents c2aa98f + ec1444b commit de6739a

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‎docs/conf.py‎

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# The short X.Y version.
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version = "2.5"
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# The full version, including alpha/beta/rc tags.
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release = "2.5.1"
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release = "2.5.5"
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# The language for content autogenerated by Sphinx. Refer to documentation
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# for a list of supported languages.

‎requirements.txt‎

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# This file is autogenerated by pip-compile with Python 3.9
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# by the following command:
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#
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# pip-compile
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#
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ase==3.22.1
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# via SMACT (setup.py)
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certifi==2023.7.22
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# via requests
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charset-normalizer==3.2.0
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# via requests
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contourpy==1.1.0
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# via matplotlib
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cycler==0.11.0
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# via matplotlib
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dill==0.3.7
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# via
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# multiprocess
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# pathos
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emmet-core==0.66.0
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# via mp-api
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fonttools==4.42.1
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# via matplotlib
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future==0.18.3
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# via uncertainties
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idna==3.4
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# via requests
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importlib-resources==6.0.1
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# via matplotlib
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joblib==1.3.2
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# via pymatgen
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kiwisolver==1.4.5
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# via matplotlib
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latexcodec==2.0.1
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# via pybtex
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matplotlib==3.7.2
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# via
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# ase
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# pymatgen
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monty==2023.8.8
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# via
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# emmet-core
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# mp-api
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# pymatgen
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mp-api==0.35.1
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# via pymatgen
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mpmath==1.3.0
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# via sympy
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msgpack==1.0.5
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# via mp-api
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multiprocess==0.70.15
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# via pathos
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networkx==3.1
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# via pymatgen
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numpy==1.24.4
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# via
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# SMACT (setup.py)
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# ase
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# contourpy
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# matplotlib
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# pandas
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# pymatgen
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# scipy
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# spglib
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packaging==23.1
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# via
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# matplotlib
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# plotly
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palettable==3.3.3
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# via pymatgen
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pandas==2.0.3
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# via
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# SMACT (setup.py)
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# pymatgen
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pathos==0.3.1
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# via SMACT (setup.py)
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pillow==10.0.1
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# via matplotlib
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plotly==5.16.1
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# via pymatgen
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pox==0.3.3
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# via pathos
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ppft==1.7.6.7
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# via pathos
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pybtex==0.24.0
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# via
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# emmet-core
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# pymatgen
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pydantic==2.5.2
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# via
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# emmet-core
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# pymatgen
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pymatgen==2023.7.20
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# via
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# SMACT (setup.py)
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# emmet-core
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# mp-api
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pyparsing==3.1.1
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# via matplotlib
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python-dateutil==2.8.2
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# via
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# matplotlib
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# pandas
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pytz==2023.3
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# via pandas
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pyyaml==6.0.1
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# via pybtex
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requests==2.31.0
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# via
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# mp-api
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# pymatgen
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ruamel-yaml==0.17.32
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# via pymatgen
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ruamel-yaml-clib==0.2.7
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# via ruamel-yaml
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scipy==1.10.1
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# via
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# SMACT (setup.py)
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# ase
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# pymatgen
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six==1.16.0
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# via
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# latexcodec
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# pybtex
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# python-dateutil
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spglib==2.0.2
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# via
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# SMACT (setup.py)
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# emmet-core
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# pymatgen
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sympy==1.12
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# via pymatgen
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tabulate==0.9.0
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# via pymatgen
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tenacity==8.2.3
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# via plotly
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tqdm==4.66.1
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# via pymatgen
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typing-extensions==4.7.1
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# via
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# emmet-core
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# mp-api
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# pydantic
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tzdata==2023.3
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# via pandas
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uncertainties==3.1.7
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# via pymatgen
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urllib3==2.0.7
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# via requests
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zipp==3.16.2
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# via importlib-resources
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# The following packages are considered to be unsafe in a requirements file:
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# setuptools
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#
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# This file is autogenerated by pip-compile with Python 3.10
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# by the following command:
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#
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# pip-compile
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#
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ase==3.22.1
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# via SMACT (setup.py)
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certifi==2023.11.17
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# via requests
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charset-normalizer==3.3.2
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# via requests
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contourpy==1.2.0
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# via matplotlib
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cycler==0.12.1
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# via matplotlib
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dill==0.3.7
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# via
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# multiprocess
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# pathos
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fonttools==4.46.0
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# via matplotlib
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future==0.18.3
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# via uncertainties
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idna==3.6
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# via requests
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joblib==1.3.2
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# via pymatgen
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kiwisolver==1.4.5
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# via matplotlib
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latexcodec==2.0.1
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# via pybtex
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matplotlib==3.8.2
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# via
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# ase
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# pymatgen
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monty==2023.11.3
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# via pymatgen
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mpmath==1.3.0
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# via sympy
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multiprocess==0.70.15
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# via pathos
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networkx==3.2.1
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# via pymatgen
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numpy==1.26.2
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# via
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# SMACT (setup.py)
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# ase
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# contourpy
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# matplotlib
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# pandas
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# pymatgen
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# scipy
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# spglib
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packaging==23.2
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# via
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# matplotlib
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# plotly
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palettable==3.3.3
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# via pymatgen
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pandas==2.1.3
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# via
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# SMACT (setup.py)
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# pymatgen
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pathos==0.3.1
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# via SMACT (setup.py)
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pillow==10.1.0
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# via matplotlib
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plotly==5.18.0
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# via pymatgen
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pox==0.3.3
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# via pathos
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ppft==1.7.6.7
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# via pathos
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pybtex==0.24.0
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# via pymatgen
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pymatgen==2023.11.12
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# via SMACT (setup.py)
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pyparsing==3.1.1
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# via matplotlib
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python-dateutil==2.8.2
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# via
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# matplotlib
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# pandas
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pytz==2023.3.post1
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# via pandas
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pyyaml==6.0.1
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# via pybtex
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requests==2.31.0
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# via pymatgen
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ruamel-yaml==0.18.5
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# via pymatgen
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ruamel-yaml-clib==0.2.8
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# via ruamel-yaml
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scipy==1.11.4
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# via
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# SMACT (setup.py)
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# ase
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# pymatgen
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six==1.16.0
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# via
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# latexcodec
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# pybtex
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# python-dateutil
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spglib==2.1.0
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# via
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# SMACT (setup.py)
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# pymatgen
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sympy==1.12
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# via pymatgen
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tabulate==0.9.0
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# via pymatgen
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tenacity==8.2.3
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# via plotly
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tqdm==4.66.1
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# via pymatgen
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tzdata==2023.3
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# via pandas
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uncertainties==3.1.7
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# via pymatgen
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urllib3==2.1.0
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# via requests

‎setup.py‎

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__copyright__ = (
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"Copyright Daniel W. Davies, Adam J. Jackson, Keith T. Butler (2019)"
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)
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__version__ = "2.5.4"
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__version__ = "2.5.5"
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__maintainer__ = "Anthony O. Onwuli"
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__maintaier_email__ = "[email protected]"
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__date__ = "November 30 2023"
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__date__ = "December 7 2023"
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import os
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import unittest

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