The STUDIA UNIVERSITATIS BABEŞ-BOLYAI issue article summary

The summary of the selected article appears at the bottom of the page. In order to get back to the contents of the issue this article belongs to you have to access the link from the title. In order to see all the articles of the archive which have as author/co-author one of the authors mentioned below, you have to access the link from the author's name.

 
       
         
    STUDIA PHYSICA - Issue no. 1 / 2006  
         
  Article:   INFRARED SPECTRUM CALCULATIONS FOR SMALL WATER CLUSTERS.

Authors:  TITUS A. BEU, ANA-MARIA FLORESCU.
 
       
         
  Abstract:  We report calculated infrared spectra for water clusters composed of up to twenty molecules, using a formalism based on second order perturbation theory. We have investigated the frequency domain between 3000 and 4000cm-1, which includes the symmetric and asymmetric bond stretching modes and the overtone of the angle bending mode. The stretch modes are found to be redshifted, while the bending mode is blueshifted  
         
     
         
         
      Back to previous page