Description
xtb - An extended tight-binding semi-empirical program package.
More information
- Homepage: https://xtb-docs.readthedocs.io
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Version | Module | Available on |
|---|---|---|
6.6.1-gfbf-2023a | chem/xtb/6.6.1-gfbf-2023a | Noctua 2 |
6.5.1-foss-2022a | chem/xtb/6.5.1-foss-2022a | Noctua 1, Noctua 2 |
6.2.3-GCC-11.2.0 | chem/xtb/6.2.3-GCC-11.2.0 | Noctua 1, Noctua 2 |
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