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casm-tools

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

Install

pip install casm-tools

Usage

See the casm docs.

Instal Zsh Completions

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

About CASM

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.

License

GNU Lesser General Public License (LGPL). Please see the file LICENSE for details.

Metadata

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