THEORETICAL-STUDIES OF CLUSTERING ROVIBRA TIONAL ENERGY-LEVELS IN THEHIGHLY EXCITED H2O MOLECULE

Citation
Jk. Xie et al., THEORETICAL-STUDIES OF CLUSTERING ROVIBRA TIONAL ENERGY-LEVELS IN THEHIGHLY EXCITED H2O MOLECULE, Huaxue xuebao, 54(3), 1996, pp. 261-265
Citations number
18
Categorie Soggetti
Chemistry
Journal title
ISSN journal
05677351
Volume
54
Issue
3
Year of publication
1996
Pages
261 - 265
Database
ISI
SICI code
0567-7351(1996)54:3<261:TOCRTE>2.0.ZU;2-R
Abstract
The clustering of rovibrational energy levels in the highly excited H2 O molecule has been investigated by using a variational procedure and the bending - rotation Hamiltion in which the radial cooridates are fi xed to their equilibrium values. This clustring effects begins with th ecritical value of total angular momentum J(c), which for H2O is 26. T he appearance of four - fold clusters of energy levels as consequence of molecular geometry stabilization is predicted. This clustering stru cture has not been brokendown in the excited vibrational states.