The casm-tools package provides pure Python CLI tools and helper functions. This includes:
- casm-calc: Setup, run, and report results of structure calculations
- casm-map: Structure mapping and import
pip install casm-tools
See the casm docs.
To install Zsh completions, cp the completions function to your custom completions directory:
cp completions/zsh/_casm_map ~/.oh-my-zsh/custom/completions/_casm-map
Then reload your shell or run:
compinit
The casm-tools package is part of the CASM open source software package, which is designed to perform first-principles statistical mechanical studies of multi-component crystalline solids.
CASM is developed by the Van der Ven group, originally at the University of Michigan and currently at the University of California Santa Barbara.
For more information, see the CASM homepage.
GNU Lesser General Public License (LGPL). Please see the file LICENSE for details.