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rmc-dft


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Author: K.Kobayashi, Kengo NAKADA
Summary: rmc_dft is a Python package for performing Reverse Monte Carlo modeling and ab initio molecular dynamics / relaxation using VASP code.
Latest version: 0.7.5
Required dependencies: coloredlogs | colorlog | dataclasses | linkify-it-py | myst-parser | nest-asyncio | packmol-util | pymatgen | pytest | pytest-asyncio | pyyaml | rmc-util | sphinx | sphinx-autobuild | sphinx-rtd-theme | sphinxcontrib-napoleon | toml | xlogger-py

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