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explicitely change box size is mode melting temp is used #225

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explicitely change box size is mode melting temp is used

explicitely change box size is mode melting temp is used #225

Run time

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Job Run time
build (ubuntu-latest, 3.9, linux-64-py-3-9, /usr/share/miniconda3/envs/my-env)
6h 0m 3s
6h 0m 3s