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Comparison of close coupling and quasiclassical trajectory calculations for rotational energy transfer in the collision of two HF molecules on a realistic potential energy surface.

Authors :
Schwenke, David W.
Truhlar, Donald G.
Coltrin, Michael E.
Source :
Journal of Chemical Physics. 7/15/1987, Vol. 87 Issue 2, p983. 10p.
Publication Year :
1987

Abstract

We report rigid-rotator close coupling calculations and quasiclassical trajectory calculations for HF–HF collisions with total angular momentum zero. The results are compared to test the trajectory method. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
00219606
Volume :
87
Issue :
2
Database :
Academic Search Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
7638913
Full Text :
https://doi.org/10.1063/1.453253