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Introduction
The purpose of this tutorial is to provide guidelines and recommendations for setting up
and solving the combustion of a lean, premixed gaseous fuel mixture of methane and air in
a conical reactor. Combustion is modeled using the finite-rate chemistry model in ANSYS
FLUENT.
This tutorial demonstrates how to do the following:
Set up and solve the combustion problem of a premixed gaseous fuel mixture of
methane and air in a conical reactor.
Prerequisites
This tutorial is written with the assumption that you have completed Tutorial 1 from
ANSYS FLUENT 13.0 Tutorial Guide, and that you are familiar with the ANSYS FLUENT
navigation pane and menu structure. Some steps in the setup and solution procedure will
not be shown explicitly.
This tutorial uses the species transport model with finite-rate chemistry and volumetric
reactions. A basic understanding of the combustion processes is desirable. For more infor-
mation on species transport and finite-rate chemistry relating to volumetric reactions, see
Section 16.1 Volumetric Reactions in the ANSYS FLUENT 13.0 Users Guide.
Problem Description
The conical combustor considered is shown in Figure 1. A small nozzle at the center of
the combustor introduces the lean methane-air mixture (equivalence ratio = 0.6) at 60 m/s
and 650 K. Combustion involves several complex reactions between CH4 , O2 , CO2 , CO,
H2 O, and N2 . The high-speed flow reverses direction in the combustor and exits through
the co-axial outlet.
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
Preparation
Step 1: Mesh
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
ANSYS FLUENT will perform various checks on the mesh and will report the progress
in the console. Make sure the minimum volume reported is a positive number.
Step 3: Models
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
(a) Select Species Transport from the Model list to open Species Model dialog box.
i. Enable Volumetric from the Reactions group box.
ii. Select methane-air-2step from the Mixture Material drop-down list.
iii. Select Finite-Rate/Eddy Dissipation from the Turbulence-Chemistry Interaction
group box.
iv. Click OK to close the Species Model dialog box.
An Information dialog box will appear informing that the material properties are changed.
Click OK.
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
Step 4: Materials
(a) Enter 0.0241 for Thermal Conductivity in the Properties group box.
(b) Click the Edit... to the right of the Mixture Species to open the Species dialog
box.
i. Add nitrogen-oxide (no) to the Selected Species list.
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
ii. Reorder the species so that nitrogen (n2) appears last in the Selected Species
selection list.
iii. Click OK to close the Species dialog box.
(c) Specify the reactions in the Reactions dialog box.
i. Click the Edit... to the right of the Reaction to open the Reactions dialog
box.
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
Reaction 1 2 3 4 5
ID
Number of 2 2 1 3 2
Reactants
Species ch4, o2 co, o2 co2 n2, o2, co n2, o2
Stoich. ch4 = 1 co = 1 co2 = 1 n2 = 1 n2 = 1
Coefficient o2 = 1.5 o2 = 0.5 o2 = 1 o2 = 1
co = 0
Rate ch4 = 1.46 co = 1.6904 co2 = 1 n2 = 0 n2 = 1
Exponent o2 = 0.5217 o2 = 1.57 o2 = 4.0111 o2 = 0.5
co = 0.7211
Arrhenius PEF=1.6596e+15 PEF=7.9799e+14 PEF=2.2336e+14 PEF=8.8308e+23 PEF=9.2683e+14
Rate AE=1.72e+08 AE=9.654e+07 AE=5.1774e+08 AE=4.4366e+08 AE=5.7276e+08
TE = 0.5
Number of 2 1 2 2 1
Products
Species co, h2o co2 co, o2 no, co no
Stoich. co = 1 co2 = 1 co = 1 no = 2 no = 2
Coefficient h2o = 2 o2 = 0.5 co = 0
Rate co = 0 co2 = 0 co = 0 no = 0 no = 0
Exponent h2o = 0 o2 = 0 co = 0
Mixing default default default A = 1e+11 A = 1e+11
Rate values values values B = 1e+11 B = 1e+11
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
Boundary Conditions
Parameters Values
Specification Method Intensity and Length Scale
Backflow Turbulent 0.003 m
Length Scale
Backflow Total Temper- 2500 K
ature
Species Mass Fractions o2 = 0.05, co2 = 0.1, and h2o = 0.1
Parameters Values
Velocity Magnitude 60 m/s
Specification Method Intensity and Length Scale
Turbulent Length Scale 0.003 m
Temperature 650 K
Species Mass Fractions ch4 = 0.034
o2 = 0.225
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Step 6: Solution
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
Step 7: Postprocessing
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
(a) Select Velocity... and Stream Function from the Contours of drop-down lists and
click Display.
(a) Ensure that all equations are selected from the Equations list and click OK to
close Equations dialog box.
(b) Set the Under-Relaxation Factors as follows:
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
Parameters Values
Density 0.8
Momentum 0.6
Turbulent Kinetic Energy 0.6
Turbulent Dissipation Rate 0.6
Turbulent Viscosity 0.6
ch4, o2, co2, co, h2o, no (species) 0.8
Energy 0.8
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
11. Compute the gas phase mass fluxes through all the boundaries.
Reports Fluxes Set Up...
(a) Calculate the Mass Flow Rate with velocity-inlet-5 as boundary.
i. Select velocity-inlet-5 from the Boundaries list.
ii. Click Compute.
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
12. Compute the gas phase energy fluxes through all the boundaries.
Reports Fluxes Set Up...
(a) Select Total Heat Transfer Rate from the Options list.
(b) Select all the zones from the Boundaries list and click Compute.
(c) Close the Flux Reports dialog box.
Step 9: Postprocessing
1. Display velocity vectors in the domain with a scale factor of 10 (see Figure 8).
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Tutorial: Premixed Flow in a Conical Chamber using the Finite-Rate Chemistry Model
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Results
The finite-rate chemistry model in ANSYS FLUENT can be used to predict the temperature
field and species mass fractions.
Summary
Application of the finite-rate chemistry model using a 5-step global chemical reaction
mechanism has been demonstrated. The 5-step global mechanism by Nicol [1] for methane
oxidation and NO formation is tuned specifically for lean, premixed combustion applications.
The mechanism is valid for a pressure of 1 Atm, inlet temperature of 650 K, and a fuel-air
equivalence ratio range of 0.45 to 0.70. Quantities presented below are in units of kmoles,
cubic meters, seconds, and Kelvin.
2. CO + 0.5O2 CO2
R2 = 1014.902 [CO]1.6904 [O2 ]1.57 exp(11613/T )
3. CO2 CO + 0.5O2
R3 = 1014.349 [CO2 v]exp(62281/T )
4. N2 + O2 2N O
R4 = 1023.946 [CO]0.7211 [O2 ]4.0111 exp(53369/T )
5. N2 + O2 2N O
R5 = 1014.967 T 0.5 [N2 ][O2 ]0.5 exp(68899/T )
References
[1] Nicol, D.G. A Chemical and Numerical Study of N Ox and Pollutant Formation in
Low-Emissions Combustion, Ph.D. Dissertation, University of Washington (1995).
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