Installation
Requirements
To work with aiida-qe-xspec, you should have:
configured an AiiDA profile.
QE code installed and configured in your AiiDA profile.
Please refer to the documentation of aiida-core for detailed instructions.
Installation
The recommended method of installation is to use the Python package manager pip:
$ pip install aiida-qe-xspec
This will install the latest stable version that was released to PyPI.
To install the package from source, first clone the repository and then install using pip:
$ git clone https://github.com/aiidaplugins/aiida-qe-xspec
$ cd aiida-qe-xspec
$ pip install -e .
The -e flag will install the package in editable mode, meaning that changes to the source code will be automatically picked up.