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

  • LiPS-GCH_22_03_1.ipynb: GCH Li2S notebook example
  • LiPS-notebooks_04_03_clean.ipynb: Li2S notebook model train test and validation
  • FeLIPS_data.tar.gz: training structure with energy labels
  • README.txt: readme file
  • fe1n4c66-li2s.cell: input file 1 CASTEP example
  • fe1n4c66-li2s.param: input file 2 CASTEP example