OpenMolcas¶
Description¶
OpenMolcas is a quantum chemistry software package.
More information¶
- Homepage: https://gitlab.com/Molcas/OpenMolcas
Availability¶
| Module | NIC5 | Hercules2 | Dragon2 | Lemaitre3 | Dragon1 |
|---|---|---|---|---|---|
| OpenMolcas/20.10-intel-2020a-Python-3.8.2 | ✓ | ||||
| OpenMolcas/21.06-intel-2020b | ✓ | ||||
| OpenMolcas/22.10-intel-2022a | ✓ | ✓ |