It helped indeed. Now the calculation runs to completion.
Thank you very much!
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- 26 Nov 2017, 20:01
- Forum: Running Dalton
- Topic: MCSCF Electronic g-tensor calculation
- Replies: 2
- Views: 2324
Dear Dalton Community, I recently got a problem running the MCSCF Electronic g-tensor calculation for my RbH2 radical. The calculation terminates with the following error: ERROR (GPOPEN) TRYING TO OPEN A NON-EXISTING OLD FILE. I made the same calculation using HF and got no problem. As well, no prob...