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Biofuels, such as biohydrogen,
biomethanol, bioethanol and biodiesel
may be the future of energy for
transportation. The methanol can
be used directly for powering Otto
engines or fuel cells; it is commonly
used in biodiesel production for
its reactivity. Biohydrogen is a
replacement for fossil and biorenewable
liquid fuels. Based on a mechanism
composed by 20 reversible elementary
reactions among 8 reactive species,
we propose a reduction process to
obtain the mechanism of hydrogen,
and from 136 reversible elementary
reactions among 30 reactive species,
we obtain a reduced mechanism for
methanol, considering velocity and
concentration of each elementary
reaction. The aim of this work is
the development of a numerical algorithm
which eliminates the fastest reactions
that destroy the steady-state species
since the slowest reactions are
rate-determining. The reduction
strategy may be summarized in 7
steps: 1. Estimate the order of
magnitude of the reaction partners;
2. Apply steady-state assumptions
to those species whose concentration
remains small; 3. Define the main
chain; 4. Identify global reactions
and their principal rates; 5. Introduce
partial equilibrium assumptions;
6. Justify the assumptions by asymptotic
analysis; 7. Identify the limitations
of the strategy. Results show that
the main advantage of the reduced
reaction mechanism is the reduced
stiffness of the system of equations.
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