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NetCDF CI & Warning for ~PBC

username-removed-151986 requested to merge lars.pastewka/ase:17_NetCDF_CI into master
  • Fixed NetCDF CI. This seems to have to with an outdated version of setuptools. My guess is that netCDF4 got updated on PyPI between my initial merge request and the final merge and now requires a later setuptools.
  • Add issuing of a warning when writing a nonperiodic system to NetCDF.

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