Quote:Frank.ramirez Dec 9th 11:47 amHi Edo.
It seems that it does not work. I tried with four cores instead of eight and the same is happening, another thing that I did not notice is that the computer seems to lag for short times and when nwchem is solving the atomic-orbital integral each executable is using much less than 100%, but, when computing the SCF (I think) the running comes back to normal (roughly 100% of the core speed).
Thanks again!
Does the same behavior occur when you run direct?
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