xtb
xtb - An extended tight-binding semi-empirical program package.
https://xtb-docs.readthedocs.io
Available modules
The overview below shows which xtb installations are available per target architecture in the HPCC module system, ordered based on software version (new to old).
To start using xtb, load one of these modules using a module load command like:
1 | |
(This data was automatically generated on Thu, 12 Jun 2025 at 12:01:24 EDT)
| neoverse_v1 | generic | zen2 | zen3 | zen4 | haswell | skylake_avx512 | |
|---|---|---|---|---|---|---|---|
| Grace Nodes | everywhere (except Grace nodes) | amd20 | amd22 | amd24 | intel16 | intel18,amd20-v100,amd21,intel21 | |
| xtb/6.6.1-gfbf-2023a | - | x | - | - | - | - | - |