Title of article :
A critical analysis of the two-dimensional atom ellipsoid model to study rotational collisions Original Research Article
Author/Authors :
J.C. Belchior، نويسنده , , J.P. Braga، نويسنده ,
Issue Information :
هفته نامه با شماره پیاپی سال 1996
Abstract :
The two-dimensional (2D) hard ellipsoid model is criticized and the calculations are compared with the 2D classical trajectory results. The scattering angle θ and the final j for a set of initial conditions (α and b) have been analyzed and it was concluded that the contribution of ∂j/∂α is the leading term in the Jacobian function. Moreover, the rainbow trajectory calculated by the hard ellipsoid model turned out to be highly accurate for low scattering angles and semi-quantative for the maximum rotational rainbow. For the latter, a relative error of about 10% has been found compared with classical trajectory results. Finally, an inversion procedure based on such a model has also been re-analyzed and better information on the anisotropy of the interaction potential was found using an exact equation rather than an approximate formula for the hard ellipsoid model.
Journal title :
Chemical Physics
Journal title :
Chemical Physics