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Hydrogen bonded OH-stretching vibration in the water dimer
- Source :
- Journal of Physical Chemistry A. Feb 1, 2007, Vol. 111 Issue 4, 567-572
- Publication Year :
- 2007
-
Abstract
- The frequencies and intensities of the hydrogen-bonded OH-stretching transitions in the water dimmer complex are calculated along with the investigation of the effects of counterpoise correcting the potential energy surface and dipole moment function. It is found that the effect of using a numeric potential is significant for higher overtones.
Details
- Language :
- English
- ISSN :
- 10895639
- Volume :
- 111
- Issue :
- 4
- Database :
- Gale General OneFile
- Journal :
- Journal of Physical Chemistry A
- Publication Type :
- Academic Journal
- Accession number :
- edsgcl.159880448