- Author
-
Raj, A.
|
Celnik, M.
|
Shirley, R.
|
Sander, M.
|
Patterson, R.
|
West, R.
|
Kraft, M.
- Title
- Statistical Approach to Develop a Detailed Soot Growth Model Using PAH Characteristics.
- Coporate
- Cambridge Univ., CB2 3RA, UK
- Journal
-
Combustion and Flame,
Vol. 156,
No. 4,
869-913,
April 2009
- Keywords
-
polycyclic aromatic hydrocarbons
|
soot
|
simulation
|
Monte Carlo method
|
validation
|
premixed flames
|
statistical analysis
- Identifiers
- kinetic Monte Carlo algorithm; kinetic Monte Carlo-aromatic site (KMC-ARS) model; PAH surface reactions; hydrogen abstraction from, and addition to free-edges, zig-zags and armchairs; hydrogen abstraction from, and addition to, 5-member rings; free-edge ring growth; free-edge ring desorption; Monte Carlo jump processes; flame initial conditions; correlation coefficients for the simulated flames; neighbor site-weights for the principal reactions for flames