Differential and integral cross sections for the H + O2 --> OH + O combustion reaction
Pascal Honvault1, Shi Ying Lin, Daiqian Xie
1Institut UTINAM, UMR CNRS 6213, University of Franche-Comté, Campus de la Bouloie, UFR Sciences et Techniques, 25030 Besançon cedex, France.
Abstract:
We present accurate differential and integral cross sections for the H + O2 --> OH + O reaction obtained on a newly developed ab initio potential energy surface using time-independent and time-dependent quantum mechanical methods. The product angular distributions near the reaction threshold show pronounced forward and backward peaks, reflecting the complex-forming mechanism. However, the asymmetry of these peaks suggests certain nonstatistical behaviors, presumably due to some relatively short-lived resonances. The integral cross section increases monotonically with the collision energy above a reaction threshold.
Related Concept Videos
Hess's Law
Enthalpy and Heat of Reaction
Combustion Energy: A Measure of Stability in Alkanes and Cycloalkanes
Alkanes undergo combustion in the presence of excess oxygen and high-temperature conditions to give carbon dioxide and water. A combustion reaction is the energy source in natural gas, liquified petroleum gas (LPG), fuel oil, gasoline, diesel fuel, and...
Thermochemical Equations
Enthalpies of Reaction
Crossed Aldol Reactions: Overview

