ANALYTIC POTENTIAL-ENERGY FUNCTION FOR DOUBLY-CHARGED IONS BH2+,CH2+ AND NH2+

Citation
Fh. Wang et al., ANALYTIC POTENTIAL-ENERGY FUNCTION FOR DOUBLY-CHARGED IONS BH2+,CH2+ AND NH2+, Journal of molecular structure. Theochem, 453, 1998, pp. 71-75
Citations number
18
Categorie Soggetti
Chemistry Physical
ISSN journal
01661280
Volume
453
Year of publication
1998
Pages
71 - 75
Database
ISI
SICI code
0166-1280(1998)453:<71:APFFDI>2.0.ZU;2-I
Abstract
An analytic potential function with four parameters, which was propose d previousely by two of the authors and can be used to describe the po tential curves for doubly charged diatomic ions with both potential mi nimum and maximum, has been discussed in detail in the present work. A s examples, this form of potential functions for ground states of BH2,CH2+ and NH2+ have been obtained for the first time. The force consta nts and spectroscopic data for these dications have also been worked o ut. (C) 1998 Elsevier Science B.V. All rights reserved.