https://github.com/superstar54/aiidalab-qe-eos

A aiidalab-qe plugin to calculate the equation of state of a crystal.
https://github.com/superstar54/aiidalab-qe-eos

Last synced: about 1 month ago
JSON representation

A aiidalab-qe plugin to calculate the equation of state of a crystal.

• Host: GitHub
• URL: https://github.com/superstar54/aiidalab-qe-eos
• Owner: superstar54
• License: mit
• Created: 2023-05-05T21:05:50.000Z (over 1 year ago)
• Default Branch: main
• Last Pushed: 2023-11-03T11:07:16.000Z (about 1 year ago)
• Last Synced: 2024-10-29T04:42:43.613Z (2 months ago)
• Language: Python
• Size: 34.2 KB
• Stars: 0
• Watchers: 2
• Forks: 0
• Open Issues: 0
• Metadata Files:
  • Readme: README.md
  • License: LICENSE

Awesome Lists containing this project

README

        
# AiiDAlab_QE EOS

A demonstration of creating a plugin to do the Equation of State (EOS) calculation inside AiiDAlab-QE.

## Installation

Git clone this repository, and `cd` into the directory. Then, install this plugin by:

```shell

pip install -e .

```

## License

MIT