Normal modes visualisation with molden
klos... at yahoo.de
Fri Oct 19 09:20:59 UTC 2007
thanks for the quick answear.
> 1) you can play with a fake output Gaussian (to be built by yourself)
> cut&pasting normal modes and
> frequenciesin order to allow molden to read the frequencies and
> normal modes
Yes, I still work on that but I havn't figured it out yet.
> 2)wait a couple of days: i will check in the molden format (will send
> a message on this forum when it's ready).. this assumes
> that you've to redo the calculations then..
That would be great. With QS my calculations don't take as long as
with gaussian, so thats no problem.
Thanks for your Help
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