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Calculation of vibrational infrared intensities and Raman activities using explicit anharmonic wave functions

Peter Seidler1, Jacob Kongsted, Ove Christiansen

  • 1The Lundbeck Foundation Center for Theoretical Chemistry, Department of Chemistry, University of Aarhus, Langelandsgade 140, DK-8000 Aarhus C, Denmark. seidler@chem.au.dk

The Journal of Physical Chemistry. A
|May 4, 2007
PubMed

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