- #1
lampo
- 1
- 0
Hi to all,
i'm not a specialist of gaussian03, so sorry if is a basic question
when i launch the DFT calculation sometimes, after several days that runs, if i check the file start to give me this lines.
Initial convergence to 1.0D-05 achieved. Increase integral accuracy.
CoulSu: requested number of processors reduced to: 2 ShMem 1 Linda.
CalDSu: requested number of processors reduced to: 3 ShMem 1 Linda.
CoulSu: requested number of processors reduced to: 3 ShMem 1 Linda.
CalDSu: requested number of processors reduced to: 3 ShMem 1 Linda.
... ... ... ... ... ... .. . ... ... ...
sometime arrive to the end of the calculation and sometimes give me error
have you a answer o suggest to do?
thanks in advance
i'm not a specialist of gaussian03, so sorry if is a basic question
when i launch the DFT calculation sometimes, after several days that runs, if i check the file start to give me this lines.
Initial convergence to 1.0D-05 achieved. Increase integral accuracy.
CoulSu: requested number of processors reduced to: 2 ShMem 1 Linda.
CalDSu: requested number of processors reduced to: 3 ShMem 1 Linda.
CoulSu: requested number of processors reduced to: 3 ShMem 1 Linda.
CalDSu: requested number of processors reduced to: 3 ShMem 1 Linda.
... ... ... ... ... ... .. . ... ... ...
sometime arrive to the end of the calculation and sometimes give me error
have you a answer o suggest to do?
thanks in advance