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Optimization by
Computational Fluid Dynamics
Curtin University & BHPB
Chemical Engineering Research Project
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Fluidized Reactor Optimization – Genghis Erkan
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Fluidized Reactor Optimization – Genghis Erkan
Executive Summery
The aim of this Research Project is to simulate the fluidised bed interaction between iron ore
and Reducing Gases (H2 and CO) using Computational Fluid Dynamics.
The velocity of the fluidising Reducing Gas is accelerated by passing through over 500
nozzles. Avoid blockages of these nozzles and insufficient fluidisation during normal
operation necessary to optimize the nozzle size and their arrangement on the grid.
Optimization is possible through the simulation on the CFD programs Gambit and Fluent.
In Gambit the structure of the reactor is created, meshed and its Boundary conditions
specified. This structure is then exported to Fluent where fluid flow conditions are initialised
Each experiment is the final product of several trials using Gambit and Fluent. It should be
noted that these experiments are only single phase. In a sense iron ore solids have yet to be
added to the simulation.
The Results of fluid simulation for A and Exp B were as expected and followed the Velocity,
Pressure and Turbulence basic principles of single phase flow. Exp C is a scale replica of
Reactor 1 and thus its complexity (incorporating 548 nozzles) has produced difficulties in
meshing in the Gambit.
This issue will be addressed in the next and final report, along with these future objectives
Patching Iron oxide onto the fluidising grid (two phase)
Optimization of nozzle sizes and grid arrangement.
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Fluidized Reactor Optimization – Genghis Erkan
Table of Contents
Acknowledgements
Executive Summary
Table of Contents
1.0 Introduction
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Fluidized Reactor Optimization – Genghis Erkan
10.0 Experiment C: Three Dimensional Scale 1:1 Reactor Simulation
10.1 Gambit Method
11.0 Conclusion
Appendices
Appendix A: Exp A Gambit Procedure
Appendix B: Reactor 1 Mechanical Drawing
Appendix C: Grid Plate and Nozzel Mechanical Drawings
Appendix D: Exp C Radial Face
Appendix E: Exp A Gambit Journal File
Appendix F: Exp B Gambit Journal File
Appendix G: Exp C Gambit Journal File
List of Figures
Fig. 1: Boodarie at night
Fig. 2: Reactor Train
Fig. 3: Reactor 1 Process Overview (section 3.0)
Fig. 4: Meshed Two Dimensional Simplified Reactor
Fig. 5: Exp. A Fluent residuals converged
Fig. 6: Exp. A Contours of Velocity Magnitude
Fig. 7: Exp. A Contours of Total Pressure
Fig. 8: Exp. A Contours of Turbulence Intensity
Fig. 9: Exp. A Velocity Vectors
Fig. 10: Exp. B Radial face of Simplified Reactor
Fig. 11: Exp. B Simplified 3D reactor with six nozzles in the grid plate
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Fluidized Reactor Optimization – Genghis Erkan
Fig. 16: Exp. B Contours of Total Pressure
List of Tables
Table 1 : Exp C Reactor 1 overview of Dimensions
Table A1: Exp A Grid Dimensions
Table A2: Exp A Coordinates of Vertices
Table A3: Exp A Node Distribution
Table A4: Exp A R1 Boundary types
Table D1: Exp C Vertex coordinates
N.B.
Each experiment is unique and thus has differing methodology and results. The method of
each experiment lies within the Gambit Construction Procedure and Fluent Initialization.
Whereas the results and discussion of each experiment is in the contour display of Velocity,
Pressure, Turbulence and Velocity Vectors.
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Fluidized Reactor Optimization – Genghis Erkan
1.0 Introduction: HBI - Boodarie Iron
Boodarie Iron is located in Port Hedland WA and operated by BHP Billiton. Most plants in the
world use blast furnaces and coke to reduce iron ore, however there are two plants in the world
(Fior, Venezuela and Port Hedland, Australia) that utilizes the unique FINMET process (FINes
METalised). In Port Hedland, Boodarie Iron reduces iron ore fines by exposing it to hydrogen
and carbon monoxide gases at 835°C in a fluidised bed reactor. This changes the ore's chemical
composition by stripping away the oxygen molecules, chemically reducing it from hematite ore
(Fe2O3) with a 68% iron content to metallic iron granules (Fe) with over 90% iron content. [1]
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(BFB)
R4
Riser
R3
R2
R1
Furnace
Reducing Gas enters through the bottom of Reactor 1, exits from the top of R1 into the bottom
of R2. (See Fig 1 above for illustration) The Reducing Gas stream eventually exits through
the top of R4. Iron ore is gravity fed into R4 and “flows” down into each reactor before exiting
R1 (92% Fe metal). [2]
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2.2 Reactor 1
2.2.2 Material Lines Input and Output (see Section 3.0) [2], [3], [4] & [5]
Solid Inlet: The solid inlet feed from R2 enters R1 already as 80% Direct Reduced
Iron (DRI). The DRI is gravity fed into the R1 via standpipes.
Solid Outlet (the Riser). The DRI exits R1 as 92% metallised iron via Riser into the
Briquetter Feed Bin (BFB). The large P between R1 (13 bar) and the BFB (2.0 bar)
results in the solid DRI particles being conveyed to the BFB were it is undergoes
further value adding.
Reducing Gas (RG) Inlet: Reducing gas from the furnace enters R1 via pipe 2007-
RP. The active gases are H2 and CO and reduces iron ore
Fe2O3 + 3H2 2Fe + 3H2O
Fe2O3 + 3CO 2Fe + 3H2O
2008-RP Reducing Gas Outlet: The reducing gas exiting R1 is then piped into the RG
inlet of R2. There is drop in pressure and temperature.
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3.0 Reactor 1 Process Overview
Reducing Gas Outlet
Press: 13.0 bar
Temp: 785C
Flow: 140660 Nm3/h
54% H2, 23%CH4, 8.0%CO
Grid Nozzles on
the Grid Plate
Solid Inlet
Metalisation: 80%
Feed Rate: 89tonnes/h
Solid Outlet
Metalisation: 92%
Feed Rate: 82 tonnes/h
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4.0 Research Honours Project Objective
4.1 Main Objective [2]
Successful fluidisation in Reactor 1 is important in order to ensure the best possible contact
between solids and gas, as well as good transfer into and out of the reactor.
For any given particle size distribution, there will be an optimum nozzle size and configuration
that will provide an ideal fluidisation state.
The fluidisation of Reactor 1 (the last reactor in series) is particularly important, since it
operates at the highest temperature and pressure, and this is traditionally where the majority of
transfer problems occur. Further optimisation may yet be possible however, to minimise the
process risk, tests first need to be done on an experimental basis.
Report Objective
The Main Objective of this Research Honours Project as the Title suggest is to optimise the
Fluidized bed Reactor at Boodarie Iron using CFD.
The nature of a fluidised bed not only depends on the nature of flow (velocity, temp) but also
the physical geometry of the reactor (nozzle diameter and configuration, and the number of
nozzles. The CFD pre-processor Gambit is to be used to conduct a series of trials and
experiments in modelling simplified and replica scale models of HBI Reactor1.
The Models are then exported to Fluent where Fluid flow is initialised. The success of these
models depend on wether they can simulate single phase fluid flow whilst obeying the Basic
Principals of Fluid Mechanics
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5.0 Literature Review [6]
As this is a progressive project, the concept and principals of Fluidisation are not used in this
report which only deals with single phase flow. However as this project develops in the future
and iron oxide is introduced in the Fluent simulation, a Literature Review on the Fluidised Bed
will be written. This is report focuses entirely on CFD…more precisely Gambit and Fluent.
CFD software allows the chemical engineer to analyse fluid flow problems in detail, faster
than testing, at an earlier stage in the design cycle, for less money and with lower risk. CFD
predicts fluid flow, heat and mass transfer, chemical reaction and related phenomena.
By solving the fundamental equations governing fluid flow processes, CFD provides
information on important flow characteristics such as pressure loss, flow distribution and
mixing rates. CFD analysis complements traditional testing and experimentation. Fluent Inc.
has two CFD programmes titled Gambit and Fluent.
GAMBIT has a single interface for geometry creation and meshing that brings together all of
Fluent's pre-processing technologies in one environment. Once Meshed, Boundary Conditions
and Continuity Types are specified before the final model is saved and exported for Fluent
Simulation.
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temperature, pressure, mass flow etc. Once initialised Fluent can visually predict fluid flow
(velocity, pressure, turbulence temperature etc) and thus optimise process operating conditions.
The novice users of Gambit and Fluent (my self included) would find that both programmes
are highly prone to user input error. If the result of a trial was not as expected or if
Gambit/Fluent identified an error, then steps a) and or b) will have had to be revisited to correct
the error or be entirely redone. Thus there would be little chance of success if not a waste of
time in creating and simulating a scale 1:1
Three Dimensional Reactor, but to only find unexpected results or errors. Thus three
experiments were designed for simulation.
Each experiment is unique and thus has differing methodology and results. The method of
each experiment lies within the Gambit Construction Procedure and Fluent Initialization.
Where as the results and discussion of each experiment is in the contour display of Velocity,
Pressure, Turbulence and Velocity Vectors.
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Turbulence Intensity decrease radially away from walls or protrusions (less friction
between fluid and walls).
The success of any trial or experiment is determined by these basic principals
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8.0 Experiment A: Two Dimensional-Simplified Reactor Simulation
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Fig 4: Meshed Two Dimensional Simplified Reactor
Just like the simplified 2D structure created in Gambit, the process flow simulation conducted
on Fluent was also simplified. The process flow in the vessel only involves the Reducing Gases
(single phase). Thus the iron/iron oxide mixture was omitted for simplification but will be
added in the future as this Research Project progresses.
The file Gambit file final2.MSH is exported to Fluent (see Appendix E for Gambit Journal
File). The following steps illustrate the initialized parameters and conditions that were set
prior to iteration.
Initialization
Multiphase off (single phase)
Viscous Model k-epsilon
Materials CO, H2, CH4 , CO2 , N2, H2O , H2S
Wall Boundary Conditions default
Fluid Boundary Conditions H2
Mass Flow Inlet Grid inlet
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8.2.2 Contours of Velocity Magnitude (Results and Discussion)
Fig 6: Shows the velocity distribution of the Reactor. The lowest velocity occurs at the reactor
walls (dark blue) and at the Grid mass flow inlet (light green). There is also as expected a
decrease in velocity (turquoise) due to the swagged shape (increase in volume) of the top half
of the reactor. The highest velocity (red) occurs at the nozzle shaped RG outlet.
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8.2.4 Contours of Turbulence Intensity % (Results and Discussion)
Fig 8: Shows the turbulence intensity distribution of the Reactor. The greatest turbulence
occurs at the Grid mass flow inlet (red & yellow). Turbulence decreases in a radial fashion
away from the wall, mass inlet and outlet (green to light blue to dark blue lowest velocity
occurs at the reactor walls (dark blue) and at the Grid mass flow inlet (light green)
8.2.5 Velocity Vectors (Results and Discussion)
DISPLAY VECTORS
COUNTOURS OF : VELOSITY
VELOCITY MAGNITUDE
DISPLAY
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9.0 Experiment B: Three Dimensional Simplified Reactor Simulation
The three coloured sections that make up the Radial face are Rotated 360 about their common
axis. A cylindrical is Created, Copied five times and Translated onto the grid plate as shown
below in Fig 11.
.
Fig 11: Simplified 3D reactor with six nozzles in the grid plate
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These six cylinders are crude representations of the grid nozzles illustrated in Fig 2. The Grid
Plate Volume was then subtracted. The remaining volumes (Above Grid Chamber, Below Grid
Chamber and the six nozzles were United to form a single volume. The unified volume was
Meshed using the Tetrahedral mesh option (Interval size = 0.2). Fig 12 below shows the
meshed product.
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9.2 Fluent Simulation
9.2.1 Fluent Method
The Fluent initialization parameters and conditions that were used for 2D Exp A was also used
for the 3D Exp B.
Initialization
Multiphase off (single phase)
Viscous Model k-epsilon
Materials CO, H2, CH4 , CO2 , N2, H2O , H2S
Wall Boundary Conditions default
Fluid Boundary Conditions H2
Mass Flow Inlet Grid inlet
Mass Flow 500kg/s
Total Temp 1108 K (835C)
Gauge Pressure 500 kPa
Iterate
Number of Iterations set 100
The iterations did not converge after 100 iterations. Further iterations (1000) did not converge
the residuals to the default value (1x10-3). The residuals did however plateau out to
approximately 4x10-3. Similarly the continuity residual also plateaus at 2x10-2. Thus any
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further iteration would have been unnecessary. Contours of pressure and velocity were then
created.
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9.2.2 Contour of Velocity Magnitude m/s (Results and Discussion)
Fig 15 above shows the Contour of Velocity Magnitude for the Simplified 3D reactor. Note
that this Figure can only show the velocity of the Reactor walls. If this was however viewed in
Fluent, the difference in velocity away from the wall can be appreciated.
As expected the lowest velocity (dark blue) occurs at the chamber walls, this is due to the Fluid
Mechanics fundamentals (fluid velocity approaches zero along the wall).
Note the nozzle walls have a greater velocity (light green) than either chamber this is of course
due to the fact that the velocity is greatly increased in accordance with the smaller nozzle
volume.
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9.2.3 Contour of Total Pressure (Pa) (Results and Discussion)
Fix 16 Above illustrates the Contours of Total Pressure. As expected the bottom chamber
where Gas enters will have the greatest pressure (orange). As the gas flows up through the
nozzles, there is a significant decrease in pressure (green) due to the increased velocity of gases
passing through the smaller volume nozzles.
The top chamber where upon the gas exits has the lowest pressure (blue), corresponding to the
high velocity produced at the nozzle and the increased volume in this chamber.
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9.2.4 Velocity Vectors (Results and Discussion)
This two figures illustrate the velocity magnitude of the gas and the direction it is travelling in
(hence the term vector). The differences between the two figures are the Scale of each vector and
the Skip or spacing between each vector.
Fig 17b clearly shows medium speed (green) gas vectors entering the lower chamber. Minor
turbulence (blue) is present in the lower chamber as gas vectors that do not enter the nozzles swirl
around this chamber.
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The velocity of swirling vectors is greater in the upper chamber where the high velocity gases
emanating from the nozzles increase the turbulence.
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Fig 17a: illustrates more clearly the effect that nozzles would have on a fluidised bed. The nozzles
increase the velocity of the gases entering the upper chamber much like a jet spray. This is where
and number of nozzles, their diameter and arrangement can be optimised and fluidised bed flow can
be simulated.
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10.0 Experiment C: Three Dimensional Scale 1:1 Reactor Simulation
Mechanical Drawings of R1, Nozzles and Grid nozzle arrangements were used (see Appendix B
and C) to create the radial faces.
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Just like in Exp 2, the radial face is created from the vertices and lines. (See Appendix D for the
coordinates on each vertex created). Fig 18 illustrates radial face. And again the three radial
faces are the ; Grid plate (blue), Above Grid Chamber (green) and Below Grid Chamber (red).
The three radial faces are again rotated by 360 to form three corresponding volumes; Grid
Plate Volume (blue), Above Grid Volume (green) and Below Grid Volume (red). As illustrated
in Fig 19 below.
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The 137 nozzles were copied and reflected about the z axis. Thus creating another 137 nozzles
(137x2 = 274nozzels) and a half grid full of nozzles. Finally the half grid of 274 nozzles were
once again copied and reflected about the x-axis. Fig 21 below shows the full grid containing
274x2 = 548nozzels.
As usual the next step required after creating all the volumes would be to mesh them.
Unfortunately problems were encountered when meshing such a large structure and complex
structure. Thus Experiment C is as yet uncompleted. (See Appendix G for Gambit Journal File)
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11.0 Conclusion
Each experiment had several trials. Over 20 trials were attempted on Gambit and about 10 on
Fluent. A majority of these trials ended in a user input error (Gambit) and unexpected fluid
flow patterns (eg: velocity vector flow through a predefined wall in Fluent). However each trial
(even failed trials) builds on the understanding and the extension for the next trial. Thus there
was an “evolution” of several trials that leads to the conception of the three final trials: Exp A,
B and C.
Experiment B proved to be more challenging when creating the structure on Gambit. The now
3D structure also incorporated six nozzles that separated an Above Grid Chamber and Below
Grid Chamber. This structure now crudely resembles Boodarie’s Reactor 1. During Fluent
iteration, residuals did not converge at the default value of 1x10-3 but instead plateau at 4x10-3.
Nevertheless contours of Velocity and Pressure were displayed. Again as expected further
success resulted since both the Velocity and Pressure contours of this reactor obeyed the Basic
Principals of Fluid Mechanics.
The Results of fluid simulation for Exp A and Exp B were as expected and followed the
Velocity, Pressure and Turbulence basic principles of single phase flow. Exp C is a scale
replica of Reactor 1 and thus its complexity (incorporating 548 nozzles) has produced
difficulties in meshing in the Gambit.
As you are well aware this is the second report of an ongoing Research Honours Project. The
project title :Fluidised Bed Optimization of Boodarie Iron’s Reactor 1 by CFD is yet to be
undertaken. However the skills developed and knowledge gained from the three experiments
are essential in order to optimize the fluidised bed of R1 using CFD.
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12.0 Problems and Recommendations
The trails and experiments proved to be very time consuming. This was of course expected
when meshing complex 3D structures in Gambit and when waiting for Residuals to converge
during fluent iterations.
A recommendation to combat the time consuming nature of CFD simulation is to run several
trials/experiments on several computers. I personally had just recently been implementing this
recommendation on five computers when attempting to mesh the complex 3D Gambit structure
of Exp C. This was however all but to avail since I always encounter the same problem of
“computer hang”. However the concept of multi-computer simulation will continue.
Another problem that was encountered during the meshing of Exp. C was insufficient
computer memory. This not only occurred during meshing, but also when rotating or resizing
the view of a complex structure on Gambit.
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Mass Flow 500kg/s
Total Temp 1108 K (835C)
Gauge Pressure 500 kPa
Iterate
Number of Iterations set 100
After 38 iterations, all of the Residuals converged to below 1x10-3. This is value is the default
value set by Fluent where upon the differences from all iterations are acceptable low values (i.e.:
1x10-3).
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Vertices and Edges
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Table A1: Grid Dimensions
Min Max Increment
x-axis -32 32 1
y-axis -32 32 1
-13 15
13 15
-13 7
13 7
-11 -12
11 -12
-11 -31
11 -31
The Create Straight Edge command allows you to create one or more straight edges between
any two or more existing vertices. The Create Real Circular Arc command allows you to
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create a real edge in the shape of a circular arc. The vertices were then connected by creating
straight edges and arcs as illustrated in Fig A2 above.
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Face and Meshing
RG
Table A3: Node Distribution Out
8, 9 N 1 4 2 5
11, 12 Y 0.8 10
6 7
2, 5 N 1 6
6, 7 N 1 12
3 4
3, 4 N 1 12
Grid
Grid Y 1.25 20
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MESH FACE MESH FACE
They are used primarily to control mesh density and, thereby, to control the amount of
information available from the computational model in specific regions of interest.
The nodes created in the previous step are used construct the mesh.
The following characteristics for the mesh was applied
ELEMENT Quad (Specifies that the mesh includes only quadrilateral mesh elements)
TYPE Pave (an unstructured grid of mesh elements)
The Quad-Pave meshing scheme, GAMBIT creates an unstructured face mesh consisting of
quadrilateral mesh elements
SPACING (INTERVAL COUNT) 10
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Boundary Types
ZONES SPECIFY BOUNDRY TYPES
Zone-type specifications define the physical and operational characteristics of the
model at its boundaries and within specific regions of its domain. There are two
classes of zone-type specifications:
Boundary types
Continuum types
This reactor model has only three Zones and thus only three boundary types:
Table A4: R1 Boundary types
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A R
D C
G
H
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Appendix D: Exp C Radial Face
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