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- Title
Effects of collision energy on stereodynamical information of the reaction F+HI→FI+H.
- Authors
MA, JIAN-JUN
- Abstract
The vector correlations between products and reactants for the reaction F+HI→FI+H are studied using quasi-classical trajectory (QCT) method. Employing a semiempirical LEPS potential energy surface constructed by Kornweitz and Persky, this work calculates the angular distributions of P( 휃), P( ϕ) and several PDDCSs in the center of mass frame. The effect of the collision energy on the product vector properties is also discussed. [Figure not available: see fulltext.]
- Subjects
COLLISION theory (Chemistry); CHEMICAL reactions; FLUORINE compounds; HYDROGEN; QUASI-classical trajectory method; POTENTIAL energy surfaces; ANGULAR distribution (Nuclear physics)
- Publication
Journal of Chemical Sciences, 2015, Vol 127, Issue 9, p1557
- ISSN
0974-3626
- Publication type
Article
- DOI
10.1007/s12039-015-0921-z