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

  • readme.txt: Detailed description of different files
  • input.data: Input data file for constructing HDNNPs using RuNNer program
  • control.in: Basic input file for DFT calculations using FHI-aims
  • local_minima.tar.gz: Zipped folder containing different local minima of NaCl clusters predicted by ee4G-HDNNP