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Institute for Powertrains & Automotive Technology Institute for Powertrains & Automotive Technology Urea Injection and Preparation in Diesel Applications Multiphase Multicomponent Modeling using Star-CD STAR European Conference 2010, London Dipl.-Phys. Simon Fischer Dr. Thomas Lauer

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Page 1: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

Institute for Powertrains

& Automotive Technology

Institute for Powertrains & Automotive Technology

Urea Injection and Preparation in

Diesel ApplicationsMultiphase Multicomponent Modeling using Star-CD

STAR European Conference 2010, London

Dipl.-Phys. Simon Fischer

Dr. Thomas Lauer

Page 2: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 2

Contents

The SCR-Process: Problem Introduction

Methodology and Analysis Setup

Thermodynamic Multicomponent Model of a Urea-Water-Solution

Droplet-Wall-Interaction and Liquid Film Dynamics

Conjugate Heat Transfer and Liquid Film Boiling

Ammonia Homogenization

Conclusion and Outlook

Page 3: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 3

Contents

The SCR-Process: Problem Introduction

Methodology and Analysis Setup

Thermodynamic Multicomponent Model of a Urea-Water-Solution

Droplet-Wall-Interaction and Liquid Film Dynamics

Conjugate Heat Transfer and Liquid Film Boiling

Ammonia Homogenization

Conclusion and Outlook

Page 4: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 4

Problem Introduction: Future Diesel Emission Limits

exhaust aftertreatment of NOx is a major requirement for future Diesel engines

[1]

NOx- Emissions [g/km]

Pa

rtic

leE

mis

sio

ns

[g/k

m]

SC

R

source: Auto News

Page 5: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 5

Principle of Selective Catalytic Reduction (SCR)

exhaust gas flow (NOx)

injection of a

water-urea mixture

32.5 mass-% urea

67.5 mass-% water

timescales of ammonia preparation

ammonia uniformity at catalyst frontal area

exhaust pipe

impingement film transport

heat transfer

ammonia (NH3) vapour

homogenization

preparation process

1) water evaporation

2) chemo-physical urea

decomposition to ammonia

(thermo-/hydrolysis)

CFD-simulation for efficient SCR-system designSCR-catalyst:„NOx+NH3 →N2 + H2O“

Page 6: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 6

Contents

The SCR-Process: Problem Introduction

Methodology and Analysis Setup

Thermodynamic Multicomponent Model of a Urea-Water-Solution

Droplet-Wall-Interaction and Liquid Film Dynamics

Conjugate Heat Transfer and Liquid Film Boiling

Ammonia Homogenization

Conclusion and Outlook

Page 7: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 7

Methodology and Validation Setup

straight exhaust pipe

urea-water-

solution-injection

from engine

exhaust gas flow

SC

R-C

ata

lyst

CFD mesh according to

experimental setup

OP 3 - high temperature / mass flow / NOx raw emission

OP2 - intermediate temperature / mass flow / NOx raw emission

OP1 - low temperature / mass flow / NOx raw emission

Analysis of Representative Operating Points (OP):

Page 8: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 8

Contents

The SCR-Process: Problem Introduction

Methodology and Analysis Setup

Thermodynamic Multicomponent Model of a Urea-Water-Solution

Droplet-Wall-Interaction and Liquid Film Dynamics

Conjugate Heat Transfer and Liquid Film Boiling

Ammonia Homogenization

Conclusion and Outlook

Page 9: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 9

Thermodynamic Multicomponent Model (Liquid Film, Droplets)

TBoil(Yurea)

Partial Pressures

(Raoult`s law):

AdBlue:

32.5 Mass.-% Urea,

67.5 Mass.-% Water

pure water:

Antoine

equation

implemented in

dropro.f, lqfpro.f

pure urea:

saturation

pressure curve

implemented in

dropro.f, lqfpro.f

)()( , TpxTp ipure

si

i

s

i

i

stot TpTp )()(

Total Pressure

(Dalton`s law):

Page 10: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 10

Decomposition of a Single Urea-Water-Solution-Droplet

water evaporation urea thermolysis

two-step preparation process modeled

[1]

[1] Wang, Baek,Lee: Experimental Investigation on Evaporation of Urea-Water-Solution Droplet for SCR Applications, AICE 2009

heat flux

through fibre,

fine tuning of

urea-psat-curve

Page 11: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 11

Contents

The SCR-Process: Problem Introduction

Methodology and Analysis Setup

Thermodynamic Multicomponent Model of a Urea-Water-Solution

Droplet-Wall-Interaction and Liquid Film Dynamics

Conjugate Heat Transfer and Liquid Film Boiling

Ammonia Homogenization

Conclusion and Outlook

Page 12: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 12

Multiphase Modeling: Challenge Of Timescales

Small Time Scales:

turbulent flow field

droplet dynamics

species (ammonia) transport

Steady-State Calculation (PISO)

fluid flow field

temperature field

no spray injection (liquid phase)

Large Time Scales:

liquid film formation and -dynamics

ammonia formation from film

wall cooling (CHT)

Transient Calculation (Simple)

thermodynamics (enthalpy)

droplets and liquid film

species (ammonia, water vap.)

time steps: 0.1 ms (droplets present)

1 ms (otherwise)

Solution Strategy:

Restart with

flow field

solvers

switched off

simulated interval of several minutes incl. spray dynamics and species transport

Page 13: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 13

Droplet Dynamics: Injection

three hole nozzle

diameter

distribution

from

measurement

timescale miliseconds

droico.f

no primary break-up modelled

Page 14: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 14

Droplet Impingement Regimes

depending on liquid properties, droplet dynamics, wall temperature,…

OP 3 – high temp.

OP2- medium temp.

OP1 - low temp

…complex behaviour

Bai-M

odel (S

w30)

Sp

rea

d-M

ode

l

Page 15: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 15

Liquid Film Formation: Validation

Experiment

(Videoanalysis)

Simulation Spread-

Model

Simulation Bai-

Model- Switch 30

OP 1

(„cold“)

extensive liquid

film, flow to pipe

bottom x

OP 2

(„medium“)

thin film after

some delay, no

remarkable flowx

OP 3

(„hot“) no permanent film x

impingement model not yet predictive across whole temperature range

not observed

in simulation

Page 16: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 16

Simulated Liquid Film Formation

OP3-Bai-Sw30

OP2-BaiSw30

OP1- Spread

OP1-BaiSw30massive liquid film with spread model in OP1

small extent liquid film with Bai model in OP1

no permanent film in OP3

transient behaviour in OP2

Page 17: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 17

Droplet Impingement and Liquid Film Dynamics

timescale millisecondstimescale minutesliquid film spread after 120 s

high

Droplet

Diameter

low

Film

Thickness

Page 18: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 18

Liquid Film Dynamics Validation

180°

90°

180°

90°

Expe

rim

ent

Sim

ula

tio

nV

ideo-A

naly

sis

[2]

Sim

ula

tion

Distribution of Liquid Film after 120 Seconds

OP1- Spread

exce

llen

td

escri

ptio

no

f film

dyn

am

ics

Page 19: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 19

Contents

The SCR-Process: Problem Introduction

Methodology and Analysis Setup

Thermodynamic Multicomponent Model of a Urea-Water-Solution

Droplet-Wall-Interaction and Liquid Film Dynamics

Conjugate Heat Transfer and Liquid Film Boiling

Ammonia Homogenization

Conclusion and Outlook

Page 20: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 20

Thermal Wall Boundary Conditions In Star-CD

Adia

batic

Fix

ed

Tem

pera

ture

Fix

ed

with

Resis

tance

Conju

gate

Heat T

ransfe

r

Rele

vance

in

SC

R-M

odelin

g

wall as a heat source !!!cooling of wall due to

evaporation !!!

thermal inertia of wall !!

wall parallel heat conduction !!

Page 21: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 21

Meshing For Conjugate Heat Transfer Approach

boundary Layer

extruded solid cells for CHT

single layer approach

fluid cells

trimmed from custom-grid

Page 22: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 22

The Nukiyama Film Boiling Model (Star-CD 4.10)

OP 3

OP2

OP1

regime positions

from experiment

(IR-thermography)

Burnout Point

Leidenfrost Point

Film-boilingTransition-

Nucleate-Convection

Page 23: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 23

Local Wall Spray CoolingOP 1-Spread

Temperature T[ C]

primary

impingement

position (water

evaporation)

Flow direction

IR-Thermography

Star-CD 4.10good qualitative representation

Page 24: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 24

Wall Spray Cooling

OP3-Bai Sw30OP2-BaiSw30

Steady State Wall CoolingDynamics of Cooling Process

OP1-Spread

IR-Themography

Star-CD 4.06

Star-CD 4.10

numerical instability

in v4.10 Bai model

for thermal break-

up-regime

(currently fixed by

Switch 30 and

NOTHBREAK

in *.prob)

Page 25: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 25

Contents

The SCR-Process: Problem Introduction

Methodology and Analysis Setup

Thermodynamic Multicomponent Model of a Urea-Water-Solution

Droplet-Wall-Interaction and Liquid Film Dynamics

Conjugate Heat Transfer and Liquid Film Boiling

Ammonia Homogenization

Conclusion and Outlook

Page 26: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 26

Film

Thickness

OP 1

Ammonia Vapour Homogenization

Ammonia-

Concentration

high

low

Page 27: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 27

Ammonia Vapour Homogenization: Validation

FTIR- measurement [2]

Ammonia-

Concentration

OP 1

Simulation

high

low

concentrations

scaled by

mean value

Page 28: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea Injection and Preparation in Diesel Applications

March 23rd 2010 | London | Simon Fischer | Slide 28

Contents

The SCR-Process: Problem Introduction

Methodology and Analysis Setup

Thermodynamic Multicomponent Model of a Urea-Water-Solution

Droplet-Wall-Interaction and Liquid Film Dynamics

Conjugate Heat Transfer and Liquid Film Boiling

Ammonia Homogenization

Conclusion and Outlook

Page 29: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea-injection and -preparation in Diesel applications

March 23rd 2010 | London | Simon Fischer | Slide 29

Conclusion

validated Star-CD-Model of the urea-water-solution preparation process:

simulation of several injection events and long time liquid film behaviour

via separated (steady) flow field and liquid-phase/thermodynamic calc.

two step ammonia preparation process modeled properly with Raoults` law

predictive impingement model for whole temperature range missing

→ massive film formation (OP1) currently forced by spread-model

→ break-up model in v4.10 (for high temp. impingement) not stable

liquid film dynamics well represented in simulation

implementation of Conjugate Heat Transfer for a correct prediction of liquid

film formation and preparation timescales (validated by IR-themography)

promising liquid film boiling model improvements from v4.06 to v4.10

Page 30: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

STAR European Conference 2010

Urea-injection and -preparation in Diesel applications

March 23rd 2010 | London | Simon Fischer | Slide 30

Outlook

check and adaption of improved Star-CDs` physical models (4.10/4.12)

NIST approach (internal calculation) for multicomp. thermodynamics properties

fix of Break-Up regime numerical instabilities of extended Bai-model (v4.10)

(currently NOTHBREAK in *.prob and Switch 30 → support)

underestimation of liquid film at low temperatures (OP1): tuning of critical

Regime Weber-Numbers to realize „one-fits-all“ Bai-impingement-model

adaption of liquid film boiling model (Nukiyama-curve) for urea-water solution

(currently standard Star-CD parameter set for pure water)

(thermography data available)

evaluation of post impingement droplet properties (e.g. size distribution)

laser-diffraction data available

towards a fully predictive SCR-process Star-CD-model

Page 31: Urea Injection and Preparation in Diesel Applications · PDF fileDipl.-Phys. Simon Fischer ... Urea Injection and Preparation in Diesel Applications March 23rd 2010 ... Urea-injection

Institute for Powertrains

& Automotive Technology

Institute for Powertrains & Automotive Technology

Thank you for your attention!

Dipl.-Phys. Simon Fischer

[email protected]