SIRIUS 

Description

SIRIUS is a domain specific library for electronic structure calculations.

More information

- Homepage: https://github.com/electronic-structure/SIRIUS

Available Versions of SIRIUS

Version

Module

Available on

Version

Module

Available on

7.3.0-foss-2021b

chem/SIRIUS/7.3.0-foss-2021b

Noctua 2

This table is generated automatically. If you need other versions please click pc2-support@uni-paderborn.de.

Usage Hints for SIRIUS

If you need support in using this software or example job scripts please click pc2-support@uni-paderborn.de.