This file is automatically generated. It contains the descriptions of each uploaded file as provided by the user.

  • README.md: Detailed description of the repository.
  • analysis.ipynb: Jupyter notebook to reproduce the figures
  • AIP.mplstyle: Matplotlib style used in the notebook
  • trajectories.zip: Folder with the MD trajectories
  • fluxes.zip: Folder with the charge fluxes
  • RPDF.zip: Folder with the radial pair distribution functions
  • cp2k_inputs.zip: Folder with CP2K inputs