Ab initio rotational and rovibrational transitions and linestrengths of He2N2+

Citation
S. Von Nagy-felsobuki et Ei. Von Nagy-felsobuki, Ab initio rotational and rovibrational transitions and linestrengths of He2N2+, J MOL SPECT, 208(2), 2001, pp. 161-165
Citations number
30
Categorie Soggetti
Spectroscopy /Instrumentation/Analytical Sciences
Journal title
JOURNAL OF MOLECULAR SPECTROSCOPY
ISSN journal
00222852 → ACNP
Volume
208
Issue
2
Year of publication
2001
Pages
161 - 165
Database
ISI
SICI code
0022-2852(200108)208:2<161:AIRART>2.0.ZU;2-#
Abstract
Ab initio calculations of transition frequencies and linestrengths for the rotational spectrum and nu (2) fundamental rovibrational of He2N2+ have bee n calculated. The calculations are based on variational solutions of an Eck art-Watson rovibrational Hamiltonian, which has embedded a highly accurate ab initio force field of Hughes and von Nagy-Felsobuki. Although experiment al data are unavailable, the ab initio data presented may be timely in assi sting laboratory and possibly interstellar detection of this helide ion. (C ) 2001 Academic Press.