Installation

Install from pip

easyunfold can be installed from pip:

pip install easyunfold

This will also install the package dependencies, if any are missing.

After installation, running easyunfold on the command-line should give the following output:

Usage: easyunfold [OPTIONS] COMMAND [ARGS]...

  Tool for performing band unfolding

Options:
  --help  Show this message and exit.

Commands:
  generate  Generate the kpoints for sampling the supercell
  unfold    Perform unfolding and plotting

Developer Installation (from source)

A recent version of pip is needed to do this, due to the new style of the pyproject.toml configuration file. To upgrade your pip, do:

pip install -U pip

Assuming the package is in the easyunfold folder, use the following command to install:

pip install ./easyunfold