Title of article
Calculation of three dimensional cross-sections for the Ar–N2 system from two-dimensional coupled equations plus a three-dimensional boundary condition
Author/Authors
Belchior، نويسنده , , J.C. and Braga، نويسنده , , J.P.، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2000
Pages
8
From page
159
To page
166
Abstract
A method was recently proposed for calculating state-to-state rotational total cross-sections that involves solving two-dimensional close-coupled equations but takes into account the three-dimensional boundary condition. In this Letter, this proposal is tested on the system Ar–N2 for a range of potential parameters that control the anisotropy of the system. In particular, the contribution of the long-range force to the cross-sections is investigated. The results are in very good agreement with the three-dimensional close-coupling calculations in the case that the molecule is initially not rotating. In all other cases the results are less satisfactory.
Journal title
Chemical Physics Letters
Serial Year
2000
Journal title
Chemical Physics Letters
Record number
1774170
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