Time-dependent wave packet and quasiclassical trajectory study of the C(3P) + OH(X 2Pi) --> CO(X 1Sigma+) + H(2S) reaction at the state-to-state level.
Bulut N, Zanchet A, Honvault P, Bussery-Honvault B, Bañares L.
Bulut N, et al. Among authors: zanchet a.
J Chem Phys. 2009 May 21;130(19):194303. doi: 10.1063/1.3125956.
J Chem Phys. 2009.
PMID: 19466832
The first calculations of state-to-state reaction probabilities and product state-resolved integral cross sections at selected collision energies (0.05, 0.1, 0.5, and 1.0 eV) for the title reaction on the ab initio potential energy surface of [Zanchet et al. J. Phys. Chem. …
The first calculations of state-to-state reaction probabilities and product state-resolved integral cross sections at selected collision ene …