Article ID Journal Published Year Pages File Type
9591716 Journal of Molecular Structure: THEOCHEM 2005 6 Pages PDF
Abstract
The time-dependent real wave packet method has been used to study S(1D)+HD reaction. State-to-state and state-to-all reactive scattering probabilities for a broad range of energy are calculated at zero total angular momentum. The probabilities for J>0 are estimated from accurately computed J=0 probabilities by using J-shifting approximation. The integral cross-sections are calculated for a large energy range.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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