cifkit

EXAMPLES

  • CIF
  • CifEnsemble

REFERENCE

  • Package API
    • Subpackages
      • cifkit.coordination package
      • cifkit.data package
        • Subpackages
        • Submodules
        • Module contents
      • cifkit.figures package
      • cifkit.models package
      • cifkit.occupancy package
      • cifkit.preprocessors package
      • cifkit.utils package
    • Submodules
    • Module contents

OTHER

  • Release Notes
  • License
cifkit
  • cifkit package
  • cifkit.data package
  • Edit on GitHub

cifkit.data package

Subpackages

  • cifkit.data.demo package
    • Module contents

Submodules

  • cifkit.data.example module
    • Example
      • Example.Er10Co9In20_file_path
      • Example.Er5In3_file_path
      • Example.ErCoIn5_file_path
      • Example.ErCoIn_folder_path
      • Example.get_path()
  • cifkit.data.mendeleev module
    • get_mendeleev_numbers()
  • cifkit.data.mendeleeve_handler module
    • get_mendeleev_nums_from_pair_tuple()
  • cifkit.data.radius module
    • get_radius_data()
  • cifkit.data.radius_handler module
    • compute_radius_sum()
    • get_CIF_pauling_radius()
    • get_is_radius_data_available()
    • get_radius_values_per_element()
  • cifkit.data.radius_optimization module
    • constraint()
    • generate_adjacent_pairs()
    • get_refined_CIF_radius()
    • objective()

Module contents

Previous Next

© Copyright 2025, Sangjoon Lee.

Built with Sphinx using a theme provided by Read the Docs.