THE H-2-NE INTERACTION

Citation
M. Faubel et al., THE H-2-NE INTERACTION, The Journal of chemical physics, 101(10), 1994, pp. 8800-8811
Citations number
32
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
ISSN journal
00219606
Volume
101
Issue
10
Year of publication
1994
Pages
8800 - 8811
Database
ISI
SICI code
0021-9606(1994)101:10<8800:THI>2.0.ZU;2-S
Abstract
New measurements of the elastic and rotationally inelastic differentia l cross sections for the Ne-D-2, Ne-H-2 system are compared with exact and approximate quantum calculations. The three most recent high qual ity, semiempirical interaction potentials available in the literature for the Ne-H-2 system yield consistent theoretical scattering cross se ctions for Ne-H-2 and for Ne-D-2. They also agree with previous and wi th present inelastic cross section measurements for D-2. However, the theory underestimates by 30% the newly measured rotational excitation in Ne-H-2 collisions discussed here. We therefore propose a new potent ial with a modified repulsive barrier that succeeds in describing both Ne-D-2 and Ne-H-2 rotationally inelastic scattering experiments for j = O-->j' = 2 within an accuracy of a few percent.