NBO
The Natural Bond Orbital (NBO) program is a discovery toolfor chemical insights from complex wavefunctions.
Available modules
The overview below shows which NBO installations are available per target architecture in the HPCC module system, ordered based on software version (new to old).
To start using NBO, load one of these modules using a module load command like:
module load NBO/7.0-gfbf-2022b
(This data was automatically generated on Thu, 26 Jun 2025 at 12:00:19 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 | |
| NBO/7.0-gfbf-2022b | - | x | - | - | - | - | - |
| NBO/7.0 | - | x | - | - | - | - | - |
| NBO/6.0 | - | x | - | - | - | - | - |