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Electronic signatures of large amplitude motions: Dipole moments of vibrationally excited local-bend and local-stretch states of [S.sub.0] acetylene
- Source :
- Journal of Physical Chemistry B. Sept 28, 2006, Vol. 110 Issue 38, 18912-18920
- Publication Year :
- 2006
-
Abstract
- A one-dimensional local bend model is used to describe the variation of electronic properties of acetylene in vibrational levels that embody large amplitude local motion on the [S.sub.] potential energy surface. The use of a one-dimensional model for the local bend is justified by comparison to the well-established polyad model which reveals a decoupling of the large amplitude bending from other degrees of freedom in the range of [N.sub.bend] = 14-22.
Details
- Language :
- English
- ISSN :
- 15206106
- Volume :
- 110
- Issue :
- 38
- Database :
- Gale General OneFile
- Journal :
- Journal of Physical Chemistry B
- Publication Type :
- Academic Journal
- Accession number :
- edsgcl.154023090