superstar54 / aiidalab-qe-vibroscopy

Geek Repo:Geek Repo

Github PK Tool:Github PK Tool

aiidalab-qe-vibroscopy

Plugin to compute vibrational properties of materials via the aiida-vibroscopy AiiDA plugin

Installation

In order to load this plugin into QeApp, you need to switch to the features/phonopy branch for your aiidalab-qe.

Then, install this plugin by:

pip install -e .
python phonopy_install.py

License

MIT

Contact

miki.bonacci@psi.ch andres.ortega-guerrero@empa.ch

About


Languages

Language:Python 100.0%