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Ab initio potential energy and dipole moment surfaces of (H2O)2
- Source :
- Journal of Physical Chemistry A. Jan 19, 2006, Vol. 110 Issue 2, p445, 7 p.
- Publication Year :
- 2006
-
Abstract
- A full-dimensional ab initio potential energy surface and dipole moment surface for water dimer are presented. The surfaces can dissociate into two water molecules correctly, with equilibrium dissociation energy D(sub e) = 1665.74 cm(super -1).
Details
- Language :
- English
- ISSN :
- 10895639
- Volume :
- 110
- Issue :
- 2
- Database :
- Gale General OneFile
- Journal :
- Journal of Physical Chemistry A
- Publication Type :
- Academic Journal
- Accession number :
- edsgcl.142527210