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- W2019698904 abstract "The effects of reaction‐path curvature and angular‐momentum state on reactive H+H2 collisions are investigated for the rotating linear model: three atoms constrained to a line with the line free to rotate in three‐dimensional space. Three vibrational adiabatic approximations to the quantum‐mechanical scattering problem are investigated after introducing Marcus' natural‐collision coordinates. Calculations based upon the Porter and Karplus H3 surface are presented for the following reaction properties: local vibrational and translational energy, reaction probabilities, and reaction cross sections. Tunneling, the internal centrifugal effect, and the energy dependence of reaction coordinates are also considered." @default.
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- W2019698904 title "Quantum Mechanics of the H+H<sub>2</sub> Reaction: Investigation of Vibrational Adiabatic Models" @default.
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