CheMPS2
- Axel Keller
Owned by Axel Keller
Description
CheMPS2 is a scientific library which contains a spin-adapted implementation of the density matrix renormalization group (DMRG) for ab initio quantum chemistry.
More information
- Homepage: https://github.com/SebWouters/CheMPS2
Available Versions of CheMPS2
Version | Module | Available on |
|---|---|---|
1.8.12-foss-2022a | chem/CheMPS2/1.8.12-foss-2022a | Noctua 2 |
1.8.11-foss-2021b | chem/CheMPS2/1.8.11-foss-2021b | Noctua 2 |
This table is generated automatically. If you need other versions please click pc2-support@uni-paderborn.de.
Usage Hints for CheMPS2
If you need support in using this software or example job scripts please click pc2-support@uni-paderborn.de.