Skip to content

Based on "Notes and tutorials on Density Functional Theory calculation using Quantum Espresso. ' for MU/HPC/AI Cluster

Notifications You must be signed in to change notification settings

snitgit/espresso-4-SciSon

 
 

Repository files navigation

Under Construction

Density Functional Theory using Quantum Espresso

Deploy gh-pages status

This repository contains the various input files and jupyter notebooks (for post processing and plotting) of the project. Please follow the tutorial at https://pranabdas.github.io/espresso/

Quantum ESPRESSO Installer

Pre-built binaries of Quantum ESPRESSO are included in the repository releases for easy installation. Currently, only Linux .deb packages are provided. Note that these packages are not well tested. If you find problems, you may open issues. Please refer to the release notes for more details on how to install.

About

Based on "Notes and tutorials on Density Functional Theory calculation using Quantum Espresso. ' for MU/HPC/AI Cluster

Resources

Stars

Watchers

Forks

Releases

No releases published

Packages

No packages published

Languages

  • Jupyter Notebook 49.7%
  • Gnuplot 41.0%
  • HTML 8.2%
  • Roff 0.6%
  • Shell 0.2%
  • CSS 0.1%
  • Other 0.2%