ASE
ASE is a python package providing an open source Atomic Simulation Environment in the Python scripting language.More Information
For more information visit the ASE website.
Available Versions
These versions of ASE are available on the BEAR systems (BlueBEAR and BEAR Cloud VMs). These will be retained in accordance with our Applications Support and Retention Policy.
| Version | BEAR Apps Version |
|---|---|
| 3.22.0-foss-2021a | 2021a |
| 3.19.1-iomkl-2019b-Python-3.7.4 | 2019b |
| 3.19.1-foss-2019b-Python-3.7.4 | 2019b |