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Interpolated potential energy surface and dynamics for the reactions between N([sup 4]S) and....

Authors :
Bettens, Ryan P.A.
Collins, Michael A.
Source :
Journal of Chemical Physics. 12/8/1998, Vol. 109 Issue 22, p9728. 9p. 1 Diagram, 1 Chart, 5 Graphs.
Publication Year :
1998

Abstract

Examines the ab initio potential energy surface for the quartet electronic state of NH[sup +][sub 3] from the collision reaction of N([sup 4]S) and H[sup +][sub 3]. Detailed exploration of the ab initio potential energy surfaces; Analysis on the reaction paths and simulation of reactions; Investigation on the possibility of surface crossing.

Details

Language :
English
ISSN :
00219606
Volume :
109
Issue :
22
Database :
Academic Search Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
4137267
Full Text :
https://doi.org/10.1063/1.477643