ASE
ASE is a python package providing an open source Atomic Simulation Environment in the Python scripting language.From version 3.20.1 we also include the ase-ext package, it contains optional reimplementationsin C of functions in ASE. ASE uses it automatically when installed.
Available modules
The overview below shows which ASE installations are available per target architecture in the HPCC module system, ordered based on software version (new to old).
To start using ASE, load one of these modules using a module load command like:
module load ASE/3.26.0-gfbf-2023a
(This data was automatically generated on Thu, 22 Jan 2026 at 12:03:27 EST)
| gateway | generic | zen2 | zen3 | zen4 | skylake_avx512 | |
|---|---|---|---|---|---|---|
| Gateway nodes | everywhere (except Grace nodes) | amd20 | amd22 | amd24 | intel18,amd20-v100,amd21,intel21 | |
| ASE/3.26.0-gfbf-2023a | - | x | - | - | - | - |
| ASE/3.23.0-gfbf-2023a | - | x | - | - | - | - |
| ASE/3.22.1-gfbf-2023a | - | x | - | - | - | - |
ASE/3.26.0-gfbf-2023a
This is a list of extensions included in the module:
ase-3.26.0, ase-ext-20.9.0, packaging-25.0, pytest-mock-3.14.1
ASE/3.23.0-gfbf-2023a
This is a list of extensions included in the module:
ase-3.23.0, ase-ext-20.9.0, pytest-mock-3.11.1
ASE/3.22.1-gfbf-2023a
This is a list of extensions included in the module:
ase-3.22.1, ase-ext-20.9.0, pytest-mock-3.11.1