Make ISODISTORT output compatible with diffpy.srfit.

This package provides tools to convert ISODISTORT output into a format compatible with diffpy.srfit for performing PDF fits with symmetry modes as fitting variables.

Minimum requirements: sympy, diffpy.srfit, diffpy.structure

Recommended: DiffPy-CMI library (https://www.diffpy.org/products/diffpycmi/index.html)

Clone or download this repository on your local machine. Navigate to the downloaded repository and run the following command (making sure that you are in the environment you created in Step 1).

>>> python setup.py install

See https://frandsengroup.github.io/isopytools/.

Ben Frandsen, Parker Hamilton.

3-Clause BSD License