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Theoretical investigation of the relaxation of the bending mode of CH2(X) by collisions with helium.

Authors :
Lifang Ma
Dagdigian, Paul J.
Alexander, Millard H.
Source :
Journal of Chemical Physics. 12/7/2014, Vol. 141 Issue 21, p1-4. 4p. 1 Chart, 4 Graphs.
Publication Year :
2014

Abstract

We have earlier determined the dependence on the bending angle of the interaction of the methylene radical (CH2) in its X3B1 state with He [L. Ma, P. J. Dagdigian, and M. H. Alexander, J. Chem. Phys. 136, 224306 (2012)]. By integration over products of the bending vibrational wave function, in a quantum close-coupled treatment we have calculated cross sections for the ro-vibrational relaxation of CH2(X). Specifically, we find that cross sections for a loss of one vibrational quantum (vb = 21 and 10) are roughly two orders of magnitude smaller, and those for a loss of two vibrational quanta (vb = 20) four orders of magnitude smaller, than those for pure rotational relaxation. In addition, no clear cut dependence on the energy gap is seen. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
00219606
Volume :
141
Issue :
21
Database :
Academic Search Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
99904157
Full Text :
https://doi.org/10.1063/1.4902004