[CPMD-list] IR and Raman

BOUYER Frédéric 153746 frederic.bouyer at cea.fr
Wed Jun 7 10:10:10 CEST 2006


Dear CPMD users,
 
I would like to know if CPMD can compute real IR and Raman intensities (and Hyper Raman ?), while computing vibrational frequencies.
 
Many thanks in advance.
 
Regards,
 
Frédéric
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