[molpro-user] Scaling factor

lilianna bryjko lbryjko at yahoo.com
Thu Sep 22 16:38:05 BST 2011


Hi,

I would like to ask about value of scaling factor in Molpro and
Molcas? I know how to calculate it having an experimental
vibrational frequencies. Unfortunately I do not have experimental
vibrations for each molecules.

Best wishes,

Lilianna
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