compositionspace 0.0.9

APT analysis tools

CompositionSpace

CompositionSpace is a python library for analysis of APT data.

Installation

Installation using pip

Compositionspace can be installed using:

pip install compositionspace

Installation using Conda

It is strongly recommended to install and use calphy within a conda environment. To see how you can install conda see here.

Once a conda distribution is available, the following steps will help set up an environment to use compositionspace. First step is to clone the repository.

git clone https://github.com/eisenforschung/CompositionSpace.git

After cloning, an environment can be created from the included file-

cd CompositionSpace
conda env create -f environment.yml

Activate the environment,

conda activate compspace

then, install compositionspace using,

python setup.py install

The environment is now set up to run calphy.

Examples

For an example of the complete workflow using compositionspace, see example/full_workflow.ipynb.

The provided dataset is a small one for testing purposes, which is also accessible here:

Ceguerra, AV (2021) Supplementary material: APT test cases. Available at http://dx.doi.org/10.25833/3ge0-y420

Documentation

Documentation is available here.