A series
of skeletal mechanisms was developed based on a decoupling
methodology to describe the oxidation of n-alkanes
from n-octane to n-hexadecane. In
the decoupling methodology, a fuel oxidation mechanism is divided
into two parts: one is an extremely simplified model for species with
a carbon atom number larger than two to simulate the ignition characteristics
of n-alkane; the other is a detailed mechanism for
H2/CO/C1 to predict the concentrations of small
molecules, laminar flame speed, and extinction strain rate. The new
skeletal mechanism includes only 36 species and 128 reactions for
each n-alkane from n-octane to n-hexadecane. The mechanism was extensively validated against
the experimental data in a shock tube, jet-stirred reactor, flow reactor,
counterflow flame, and premixed laminar flame. Good agreements on
ignition delay, the concentrations of major species, laminar flame
speed, and extinction strain rate between the predictions and measurements
were obtained over wide ranges of temperature, pressure, and equivalence
ratio, which demonstrates the capability of the decoupling methodology
to build skeletal oxidation mechanisms for n-alkanes.
Due to the compact size of the new skeletal mechanism, it can be easily
integrated into the computational fluid dynamics (CFD) simulation.
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