Elastic is a code developped by Paweł T. Jochym
For more information check the manual
Installing
Before installing the code we need to installing the following:
you need to get the conda package manager ( installit from here )
conda create -n elastic
conda activate elastic
(elastic) conda install gcc
(elastic) conda install numpy
(elastic) conda install spglib
(elastic) conda install matplotlib
(elastic) conda install ase
(elastic) conda install -c conda-forge elastic
Testing the installation
The simplest verification if everything works is just using the elastic utility to see the help screen:
elastic --help
or version of the package:
elastic --version
Additionally the whole package has a set of unittests based on hypothesis package. The tests are self-contained and do not require any external packages like DFT programs (e.g. VASP). You can run these tests by executing following
command in the source directory:
python -m unittest discover -s test -b
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