Tutorials Manual
Tutorials Manual
Tutorials Manual
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Chapter 3: Catalytic Processes<br />
<strong>Tutorials</strong> <strong>Manual</strong><br />
3.1.1.2 Problem Setup<br />
The CHEMKIN project file for this tutorial problem is called<br />
reactor_network__two_stage_catalytic_combustor.ckprj located in the default<br />
sample directory. We are going to use methane as the main fuel in our micro-turbine<br />
combustor system, so we choose GRI Mech 3.0, as described in section<br />
Section 2.8.2, to handle the gas phase combustion and, for the catalytic combustion,<br />
the surface reaction mechanism developed by Deutschmann et al. 28 for methane<br />
oxidation on platinum catalyst, as described in section Section 3.3.1, is employed.<br />
The chemistry set, reactor_network__two_stage_catalytic_combustor.cks, which<br />
includes the gas phase (GRI methane oxidation mechanism) and surface<br />
(Deutschmann’s methane/platinum catalytic oxidation mechanism) reactions can be<br />
found in the working directory samples\reactor_network\<br />
two_stage_catalytic_combustor. Since we will use only the perfectly stirred reactor<br />
(PSR) and plug flow reactor (PFR) in our model, we do not need any transport data.<br />
Before building a model for our combustor system, we need to find out all the<br />
important parameters of the system. The total mass flow rate of our sub-scale microturbine<br />
system has to match the gas-turbine design point, which, in our case, is<br />
980 g/sec. Since this designed flow rate is too large to be handled by a single<br />
combustor, we divide the flow evenly into 6 identical combustor units in parallel and<br />
merge them before entering the gas turbine. We set the mass flow rate of each<br />
catalytic combustor to 127 g/sec so that there is about 21.5% (or 35 g/sec) excess air<br />
per combustor for liner cooling and downstream dilution. Methane and compressed<br />
air are pre-mixed before entering the catalytic combustor. We keep the fuel-air<br />
mixture very lean so it will not ignite before reaching the catalytic combustor. The gas<br />
temperature and pressure at the inlet of the catalytic combustor are 715 K and<br />
3.75 atm, respectively. The inlet gas temperature is higher than that of a<br />
homogeneous combustor. We have to use a higher inlet gas temperature to ensure a<br />
light-off (or surface ignition) on the catalyst surface. Note that we could lower the inlet<br />
temperature if a palladium-based catalyst were used or if a small amount of hydrogen<br />
were added to the fuel. However, at this point, we consider methane as the only fuel<br />
component.<br />
The catalytic combustor is 10 cm in diameter and 10 cm long. It consists of a metal<br />
outer liner providing structure support and a honeycomb monolith core. The catalyst is<br />
coated on all internal surfaces of the monolith. The cell density of the honeycomb<br />
monolith we selected is 400 cpsi (cells per square-inch) and the cell wall thickness is<br />
0.18 mm. The pressure drop across the monolith is determined to be 0.064 psi/cm for<br />
the given flow rate. 5.2 grams of platinum are wash-coated onto the internal surfaces<br />
28. Deutschmann et al., Proceedings of Combustion Institute, 26:1747-1754 (1996).<br />
RD0411-C20-000-001 93 © 2007 Reaction Design