Journal article
A full-dimensional quantum dynamical study of H2+H2 collisions: Coupled-states versus close-coupling formulation
Abstract
Collision-induced energy transfer involving H2 molecules plays an important role in many areas of physics. Kinetic models often require a complete set of state-to-state rate coefficients for H2+H2 collisions in order to interpret results from spectroscopic observations or to make quantitative predictions. Recent progress in full-dimensional quantum dynamics using the numerically exact close-coupling (CC) formulation has provided good agreement …
Authors
Bohr A; Paolini S; Forrey RC; Balakrishnan N; Stancil PC
Journal
The Journal of Chemical Physics, Vol. 140, No. 6,
Publisher
AIP Publishing
Publication Date
February 14, 2014
DOI
10.1063/1.4864357
ISSN
0021-9606