- Author
-
Harding, L. B.
|
Klippenstein, S. J.
|
Georgievskii, Y.
- Title
- Reactions of Oxygen Atoms With Hydrocarbon Radicals: A Priori Kinetic Predictions for the CH3 + O, C2H5 + O and C2H3 + O Reactions.
- Coporate
- Argonne National Laboratory, IL
Sandia National Laboratories, Livermore, CA
- Book or Conf
- Combustion Institute, Symposium (International) on Combustion, 30th. Proceedings. Volume 30. Part 1. July 25-30, 2004,
Combustion Institute, Pittsburgh, PA,
Chicago, IL,
Chen, J. H.; Colket, M. D.; Barlow, R. S.; Yetter, R. A., Editors,
985-993 p.,
2005
- Keywords
-
combustion
|
kinetics
|
methyl radicals
|
ethyl radicals
|
vinyl radicals
|
equations
|
oxygen
|
hydrocarbons
- Identifiers
- electronic structure methods; lectronic structure results; transition stte theory; trajectory simulations