A python package to help with quantum espresso calculations. Prepares inputs, parses outputs, performs analysis.
-
Updated
Oct 9, 2017 - HTML
A python package to help with quantum espresso calculations. Prepares inputs, parses outputs, performs analysis.
Quantum ESPRESSO Calculator for Atomic Simulation Environment (ASE).
Add a description, image, and links to the quantum-espresso topic page so that developers can more easily learn about it.
To associate your repository with the quantum-espresso topic, visit your repo's landing page and select "manage topics."