ISSN:
1434-6079
Keywords:
31
;
36
Source:
Springer Online Journal Archives 1860-2000
Topics:
Physics
Notes:
Abstract The results of an extensive configuration interaction study of the singlet valence-type electronic states of HCN are presented. Potential surfaces corresponding to large amplitude variations of all three vibrational coordinates are calculated. Special attention is paid to a description of the bending and of the H-CN dissociation processes. The overall agreement with available experimental findings promises a successful interpretation of the observed spectra, which will be the topic of a subsequent paper.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1007/BF01436576
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