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Abstract - The properties force CNG HCCI engines to use ex- The chemical kinetics of combustion is extremely com-
treme levels of intake heating and high compression ratio. This plicated, and this is especially so for auto-ignition processes.
leads inherently to a high rate of heat release and, in conse- In the 1970s, based on degenerate branched-chain and class
quence, the air/fuel mixture must be highly diluted with air chemistry concepts, reduced kinetic models were developed
and/or EGR to avoid heavy knocking. In HCCI combustion, the
ignition timing is not dictated by the timing of the spark as in
for prediction of auto-ignition delay time in an engine [9]
spark-ignition engines or by the injection of fuel as in diesel and this work formed the basis for later development of sev-
engines. Instead, HCCI ignition timing is controlled by com- eral reduced chemical kinetic models [10] and [11]. Since
pression-induced chemical kinetics. Accurate simulation of the 1980s, detailed chemical kinetic models relevant to end
HCCI ignition requires detailed kinetic models of the fuel com- gas auto-ignition of stoichiometric combustion have
bustion over the wide range of pressures and temperatures that emerged. However, there are hundreds of species and chemi-
may exist inside the cylinder volume. Experiments were con- cal reaction equations needed to simulate the ignition and
ducted at three different intake conditions at a speed of 1500 combustion process even for simple hydrocarbons such as
RPM, CR=19 and at intake pressure of 150kPa for different the butanes [12] and [13]. Needless to say, the situation gets
cooled EGR ratios. The CHEMKIN-PRO Multi-Zone Engine
Model used in concert with CFD modeling by incorporating
more complicated as one moves to more complex, higher
information from a CFD cold-flow simulation prior to a point molecular weight fuels such as n-heptane [14]. Nonetheless,
in the compression cycle where kinetics become important several modeling studies using detailed chemical mecha-
(typically, up to 30 CAD ATDC), and then creating zones based nisms have been reported to simulate HCCI combustion.
upon the stratification information from the CFD solution. At Some used a single-zone model [15] and [16] and others
all loads the effect of increasing EGR leading to longer burn used a multi-zone model along with CFD [17] and [18].
duration was confirmed reduce knock severity, reduce nitrogen Over the last few years, a consensus has developed as to the
oxides (NOx) emission. The Multi-Zone Engine Model predic- nature of HCCI combustion. It is now generally agreed that
tions agree reasonably well with the experimental results for HCCI combustion is dominated by local chemical-kinetic
various parameters over the entire EGR-AFR operating range.
reaction rates [19] with no requirement for flame propaga-
Keywords: Homogeneous Charge Compression Ignition, Com- tion. This notion has been supported by spectroscopic data
pressed Natural Gas, Computational Fluid Dynamics, Heat Release indicating that the order of radical formation in HCCI com-
Model, Exhaust Gas Recirculation bustion corresponds to self-ignition rather than flame propa-
gation. [20] and [2] Recent analytical developments also
I. INTRODUCTION support the view that HCCI combustion is dominated by
Since 1979 when a two stroke HCCI engine was pro- chemical kinetics, and an analysis methodology based on
posed [1] several experimental and modeling studies have this premise has had considerable success in predicting
been undertaken to expand the operating range and control HCCI combustion and emissions with multi–zone model
combustion timing. Basic studies showed that HCCI com- [18].
bustion is controlled by chemical kinetics, sharing many
similarities with knock in SI engines. More studies have a) The Multi-zone model:
been undertaken to overcome HCCI disadvantages. Intake This model can be used to do detailed performance anal-
temperature Adjustment[2], relative air/fuel ratio (l) EGR ysis and to study fundamentals of HCCI combustion. The
adjustment [3], variable compression ratio[4], variable valve multi-zone model can take full account of the effect of tem-
timing[5], boosted intake pressure[6], early/late in-cylinder perature (and possibly concentration) gradients inside the
fuel injection strategies[7] and dual mode SI-HCCI engine combustion chamber. The multi-zone model combines a
have been proposed as partial solutions. detailed fluid mechanics code with a detailed chemical kinet-
ics code.
Several HCCI engines fueled with natural gas have been
demonstrated. For example [8], a 6-cylinder diesel engine A multi-zone Homogeneous Charge Compression Igni-
was modified to run in HCCI mode as a single cylinder en- tion combustion model was developed for use within the
gine using a compression ratio of 21 and intake temperature CHEMKIN-PRO software framework. The CHEMKIN-PRO
of 120°C. Successful HCCI operation was demonstrated over 2008 multi-zone model allows the possibility of adopting the
l= 2:2 to 3:5. Also a supercharged HCCI engine was operat- hybrid solution approach developed by Aceves et al 2000[2].
ed with compression ratios of 19 and 17, intake temperatures The Multi-zone model can also be used independently, using
of 150°C and 170°C respectively. For most CNG-fueled specified heat-transfer parameters from the start of simula-
HCCI engines, the compression ratio and intake temperature tion after intake valve closing model description following
were chosen to be high. the multi-zone model approach reported by Aceves et al.
2001[21].
10.0
condition was bounded by the onset of engine knock. The fuel
9.5
was CNG. 9.0
Burn Duration (CAD)
8.5
Table 2: Experiment and simulation boundary conditions for CNG 8.0
fueled HCCI with varying EGR experiments 7.5 EXP Low Load
EXP Mid Load1
LowLoad Mid Load 1 Mid Load 2
7.0
EXP Mid Load2
6.5 CHEMKIN-PRO Low Load
TIntake=130°C TIntake=110°C TIntake=100°C 6.0
CHEMKIN-PRO Mid Load1
CHEMKIN-PRO Mid Load2
EGR λ EGR λ EGR λ 5.5
-1.0
-1.5
-2.0
tion, and second, reductions of O2 concentration limits availa-
-2.5
-3.0
ble O2 for combustion reactions. The re-circulated gas con-
-3.5
-4.0
tains three-atomic molecules, H2O and CO2. The concentration
-4.5
-5.0
of O2, one of the reactants, is lowered and the concentrations
-5.5
0 10 20 30 40 50
of CO2 and H2O, the products, are increased. This slows down
EGR % the reactions in the oxidizing direction and speeds up the reac-
tions in the reverse direction. The figure shows quite big dif-
Figure 1. Start of combustion versus EGR at three load condition in
both experimental and simulation study
ferences in the peak temperatures between different loads.
Some of this deviation is of course due to the higher intake
temperature for the lower load, but this is compensated for by NOx emissions can be further decreased by the cooled EGR
the lower increase in temperature due to higher load. rate.
EXP Low Load
EXP Mid Load1
EXP Low Load 165
160 EXP Mid Load2
EXP Mid Load1
155 SKM Low Load
1680
EXP Mid Load2
150 SKM Mid Load1
CHEMKIN-PRO Low Load
1660
145 SKM Mid Load2
CHEMKIN-PRO Mid Load1 140
130
1620 125
120
1600 115
110
1580
105
1560 100
95
1540 90
85
1520 80
1500 0 10 20 30 40 50
0 10 20 30 40 50 EGR %
EGR %
Figure 4. Peak HRR versus EGR at three load condition in both ex-
Figure 3. Peak Temperature versus EGR at three load condition in perimental and simulation study
both experimental and simulation study.
The peak heat release rate with respect to EGR% in both 420
380
limiting effect of EGR on peak pressures and rate of pressure EXP Low Load
EXP Mid Load1
360 EXP Mid Load2
rise is evident from examination of these figure 4. The in- 340
CHEMKIN-PRO Low Load
CHEMKIN-PRO Mid Load1
crease in specific heat of the mixture due to EGR is also made
IMEP (kPa)
CHEMKIN-PRO Mid Load2
320
clear by the compression behavior documented in these fig- 300
in Figure 6. It is found from Figure 5 that for the highest load 240
220
condition, the limitations of the EGR cooler on without caus-
0 10 20 30 40 50
ing knocking or combustion fluctuation and misfire., with EGR %
lower ratio of specific heats,
C p
Figure 5. IMEP versus EGR at three load condition in both experi-
C v
mental and simulation study
.
The brakes specific emissions of carbon monoxide with EXP Low Load
respect to EGR% in both experimental and simulation study EXP Mid Load1
23.5 EXP Mid Load2
are shown in Figure 6. It is noticed from Figure 7 that influ- 23.0
CHEMKIN-PRO Low Load
CHEMKIN-PRO Mid Load1
ence of cooled EGR on HCCI emissions including CO, UHC, 22.5 CHEMKIN-PRO Mid Load2
and NOx. UHC is mainly due to the chain termination during
BSCO (g/kW-hr)
22.0
such as boundary layer, near the walls, and crevice layer. 20.5
20.0
19.5
Essentially, the main factor determining the UHC and CO
19.0
level is the in-cylinder gas temperature. With increasing EGR 0 10 20 30 40 50
EGR %
rate, the ignition and combustion events occur near or after the
TDC, and then the uncompleted reaction products in the Figure 6. BSCO versus EGR at three load condition in both experi-
boundary layer and crevice layer discharge into the exhaust mental and simulation study
pipe during the expansion stroke. Furthermore, the gas tem-
perature decreases with the increase of EGR rate, and further
oxidation in the exhaust pipe also reduces. These conditions 26
22
EGR% in both experimental and simulation study are shown
in Figure 7. The unburned hydrocarbon emission is a result of 20 EXP Low Load
EXP Mid Load1
incomplete combustion. The NOx emissions with respect to EXP Mid Load2
EGR% in both experimental and simulation study are shown 18 CHEMKIN-PRO Low Load
CHEMKIN-PRO Mid Load1
in Figure 8. Nitrogen oxides or NOx are formed in most com- CHEMKIN-PRO Mid Load2
16
bustion processes where nitrogen is present. NOx is a collec-
tive term for NO, NO2, but also nitrous oxide, N2O, is some 0 10 20 30 40 50
EGR %
times added to this term. NO and NO2 emissions. The NOx
emissions, the major advantage of HCCI combustion is ultra Figure 7. BSHC versus EGR at three load condition in both experi-
NOx emissions. This can be verified in Fig 8. Moreover, the mental and simulation study
0.010
0.009
gines for Heat Release Prediction”, SAE Paper No. 922328,
0.008
SAE Trans.,Section 5.
[12] Cernansky, N.P., Green, R.M., Pitz, W.J. and Westbrook, C.K.
0.007
(1986): “Chemistry of Oxidation Preceding End-Gas Autoigni-
0.006
tion”, Comb. SciTechnol., 50, 3-25.
0.005
10 20 30 40 50 [13] Green, R.M., Cernansky, N.P., Pitz, W.J. and Westbrook, C.K.
EGR % (1987): “The Role of Low Temperature Chemistry in the Au-
toignition of n-Butane”, SAE Paper No. 872109, SAE Trans.,
Figure 8. BSNOx versus EGR at three load condition in both experi- 96.
mental and simulation study [14] Curran, H.J., Gaffuri, P., Pitz, W.J. and Westbrook, C.K.
(1998): “A Comprehensive Modeling Study of n-Heptane Oxi-
V. CONCLUSION dation”, Combust. Flame 114: 149-177.
At all loads the effect of increasing EGR leading to longer [15] Kelly-Zion, P.L. and Dec, J.E. (2000): “A Computational Study
burn duration was confirmed. This is in good agreement with of Effect of Fuel-Type on Ignition Time In HCCI Engines”,
CHEMKIN-PRO simulation findings. CHEMKIN-PRO al- Proc. Combust. Inst.
lows rapid evaluation of fuel mixture, engine performance, [16] Aceves, S.M., Smith, J.R., Westbrook, C.K. and Pitz, W.J.
accurate NOx, CO and UHC emissions predictions, platform (1999): “Compression Ratio Effect on Methane HCCI Combus-
for combustion stability analysis and lean blow off assess- tion”, ASME Journal of Engineering for Gas Turbines and Pow-
er, Vol. 121, pp. 569-574.
ment. In most cases studied, increases in EGR led to decreas- [17] Kraft, M., Maigaard, P., Mauss, F., Christensen, M.,and Johans-
es in NOx. The influence of EGR on combustion behavior was son, B. (2000): “Investigation of Combustion Emissions in a
as expected, extending burn duration, limiting rates of pres- HCCI Engine- Measurements and A New Computational Mod-
sure rise, and minimizing peak rates of heat release. Cooler el”, Proc. Combust. Inst. 28, Paper No. 4E12, (in press).
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increased. Pitz, W., Dibble, R., Christensen, M. and Johansson, B. (2000).
A Multi-Zone Model for Prediction of HCCI Combustion and
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deg, which is a faster rate than was observed in the experi- 790840.
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