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Author
Celnik, M. | Raj, A. | West, R. | Patterson, R. | Kraft, M.
Title
Aromatic Site Description of Soot Particles.
Coporate
Cambridge Univ., CB2 3RA, UK
Journal
Combustion and Flame, Vol. 155, No. 1/2, 161-180, October 2008
Keywords
soot | particles | simulation | polyaromatic hydrocarbon | Monte Carlo method | hydrogen | kinetics | equations | carbon | algorithms | particle size distribution | soot formation
Identifiers
hydrogen-abstraction carbon-addition (HACA) processes; PAH surface reactions; hydrogen abstraction; Monte Carlo jump processes; 2D PAH structure kinetic Monte Carlo (KMC) code; site-counting model; changes to particle state due to jump processes; particle site state changes when a six-member ring is added beside a site (incrementing); neighbouring site probability weight distributions for each stochastic process; experimental plug-flow reactor (PFR) studies; carbon to hydrogen (C/H) ratio