Normal modes visualisation with molden

woody klos... at
Fri Oct 19 08:30:54 UTC 2007


I want to calculate some IR-Spectra, so I did a normal mode
(VIBRATIONAL_ANALYSIS) on my molecule. I also got normal modes but I
cannot visualise them with molden, because molden cannot read the
output format.

I need molden, because with molden I can get the frequencies and
intesities so I can plot them with gnuplot.

Has anyone a suggestion how molden can read my output?

Or does anyone know another visualisation tool which can do the same

Thanks for Help


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