Full Text
Advanced Search

Physical Chemistry Chemical Physics

High quality research in physical chemistry, chemical physics and biophysical chemistry.


Evaluation of range-separated hybrid density functionals for the prediction of vibrational frequencies, infrared intensities, and Raman activities

Corresponding authors
Department of Chemistry, Rice University, Houston, USA
E-mail: guscus@rice.edu
Phys. Chem. Chem. Phys., 2008,10, 6621-6629

DOI: 10.1039/B810877C
Received 26 Jun 2008, Accepted 22 Aug 2008
First published online 01 Oct 2008
Please wait while Download options loads

Supplementary Info