- Author
-
Cavallotti, C.
|
Fascella, S.
|
Rota, R.
|
Carra, S.
- Title
- Quantum Chemistry Study of the Formation of PAH and Soot Precursors Through Butadiene Reactions.
- Coporate
- Politecnico di Milano, Dipartimento Chimica, Materiali e Ingegneria Chimica "G. Natta"/CIIRCO, Milan, Italy
- Journal
-
Combustion Science and Technology,
Vol. 176,
No. 5/6,
705-720,
May/June 2004
- Keywords
-
polyaromatic hydrocarbons
|
soot
|
quantum chemistry
|
butadiene
|
equations
|
kinetics
- Identifiers
- evaluation of transition state theory (TST) rate coefficients; Quantum Rice Ramsperger Kassel (QRRK) calculations