Article ID Journal Published Year Pages File Type
5375943 Chemical Physics 2008 11 Pages PDF
Abstract
The total angular momentum (J = 1, 10) S matrix elements of the Li + HF reaction have been calculated using a time independent method, and matrix transformed to the stereodirected and Gauss-Legendre discrete variable representations. This paper extends to higher partial waves the study on the stereodynamics of the Li + HF reaction performed at a total angular momentum J = 0. The work is focused on the orbital angular momentum (L) substates rather than on the projections K on the intermolecular axis and emphasis is given to a space-fixed rather than to a body fixed view of the collision process. A detailed comparison of stereodirected and discrete variable representations is also made.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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