Welcome to pdos_overlap’s documentation!

Getting Started:

• pDOS_overlap
  • Documentation
  • Developer
  • Dependencies
  • License

Contents:

• pdos_overlap
  • The get_adsorbate_indices function
  • The PDOS_OVERLAP class
• vasp_dos
  • The get_data_path function
  • The get_example_data function
  • The get_all_VASP_files function
  • The get_band_center function
  • The get_bond_energy function
  • The get_band_width function
  • The get_orbital_proximity function
  • The get_second_moment function
  • The get_filling function
  • The VASP_DOS class
• overlap_population
  • The write_lobsterin function
  • The get_example_data function
  • The get_all_lobster_files function
  • The get_bonding_states function
  • The OVERLAP_POPULATION class
• coordination
  • The get_geometric_data function
  • The Coordination class
• plotting_tools
• error_metrics
• Examples
  • Band center calculation example
  • Orbital overlap calculation example
  • Overlap population examples
  • Projected density examples

Indices and tables

• Index

• Module Index

• Search Page