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Getting Started

  • Installation
  • Your first calculation

Background

  • Theory
  • References

User guide

  • Input format
  • Running from the command line
  • Calling within python

Tutorials

  • Orbital energies
  • Band structures
  • Screening parameters from a trained model
  • Dielectric constants
koopmans
  • Overview: module code

All modules for which code is available

  • koopmans.api
  • koopmans.input_file
    • koopmans.input_file.atomic_positions
    • koopmans.input_file.cell_parameters
    • koopmans.input_file.kcp
    • koopmans.input_file.ml
    • koopmans.input_file.parallelization
    • koopmans.input_file.pw
    • koopmans.input_file.pw2wannier90
    • koopmans.input_file.unfold_and_interpolate
    • koopmans.input_file.wannier90
    • koopmans.input_file.workflow
  • wannier90_input.models.parameters

© Copyright 2026, Edward Linscott.

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