Quantal coupled channels calculations of the rates of self-relaxation of ortho- and para-H-2

Authors
Citation
Dr. Flower, Quantal coupled channels calculations of the rates of self-relaxation of ortho- and para-H-2, J PHYS B, 33(22), 2000, pp. 5243-5249
Citations number
16
Categorie Soggetti
Physics
Journal title
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS
ISSN journal
09534075 → ACNP
Volume
33
Issue
22
Year of publication
2000
Pages
5243 - 5249
Database
ISI
SICI code
0953-4075(20001128)33:22<5243:QCCCOT>2.0.ZU;2-C
Abstract
We have computed thermally averaged rate coefficients for vibrational self- relaxation nu = 1 --> 0 of ortho- and para-H-2. The quantum mechanical, cou pled channels method was employed, with bases which are adequate to ensure convergence of the results at the kinetic temperatures (T = 300 and 500 K) considered. Although the inclusion of excited rotational states of the pert urber molecule leads to increases in the rate coefficients for vibrational relaxation, these increases are insufficient to reconcile the theoretical r esults with experimental measurements.