re: g92 MULTIPLICITY=2 PROBLEM.
S O S S O S S O S.
I'm not very sure if this is a correct forum. I will pose the quetion
anyway. I tried frequency jobs with Nitric Oxide (multiplicity=2).
The theoretical value is 3915 wavenumbers, this is about twice
experimental one. PROBLEM 1
The other systems with multiplicity=1 do not pose such a problem.
With Nitrogen dioxide also multiplicity=2, the calculation on
frequencies just won't proceed, i.e crashes by exceeding normal 65
cycles. PROBLEM 2
Now the question is this? Has anyone out there, encountered these
problems on Gaussian 92 in Unix system? Please help.
Thanks in advance;
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