Rd. Vandell et al., A GLOBAL KINETIC-MODEL FOR THE FORMATION AND DESTRUCTION OF THE PRODUCTS OF INCOMPLETE COMBUSTION PRODUCED FROM THE COMBUSTION OF O-DICHLOROBENZENE, Combustion science and technology, 100(1-6), 1994, pp. 225-243
Data on combustion samples obtained from burning o-dichlorobenzene, ta
ken earlier (Van Dell and Mahle, 1992), were used to develop a three s
tep semi-empirical global kinetic model to describe the formation and
destruction of various Products of Incomplete Combustion (PICs). This
model assumes that the reactions occur consecutively in the post flame
temperature range and that the reverse reaction rates are negligible.
Using this model, in conjunction with selected activation energies, c
oncentration vs. temperature profiles for the various PICs were constr
ucted that match the experimental data. Activation energies selected w
ere generally taken from the literature to represent both the homogene
ous and heterogeneous systems. Important processes considered in this
model include chlorination, dechlorination, adsorption, coupling, deco
upling and cyclization reactions. Measured temperature vs. distance pr
ofiles were utilized along with the kinetic concentration/temperature
profiles to construct concentration vs. distance profiles for various
PICs. The model was used to predict emission levels at the final quenc
h temperature; predictions compared well with experimental values. Als
o, the concentration vs. distance profiles helped elucidate the domina
nt global reaction pathways. Once developed and tested, this global me
chanism can be integrated into a comprehensive computational fluid dyn
amics (CFD) model. The resulting CFD based kinetic model will enhance
our ability to predict the formation potential for various PIC's occur
ring during the combustion of chlorinated organic wastes in industrial
scale incineration devices.