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Schramm 1990
Schramm 1990
SAE Technical
Paper Series
902169
A Model for Hydrocarbon Emissions from
SI Engines
Jesper Schramm and Spencer C. Sorenson
Laboratory for Energetics
Technical University of Denmark
ISSN 0148-7191
Copyright 1990 Society of Automotive Engineers, Inc.
Positions and opinions advanced in this paper are those of Persons wishing to submit papers to be considered for
the author(s) and not necessarily those of SAE. The author presentation or publication through SAE should send the
is solely responsible for the content of the paper. A process manuscript or a 300 word abstract of a proposed
is available by which discussions will be printed with the manuscript to: Secretary, Engineering Activity Board, SAE.
paper if it is published in SAE Transactions. For permission
to publish this paper in full or in part, contact the SAE
Publications Division. Printed in USA
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902169
A Model for Hydrocarbon Emissions from
SI Engines
Jesper Schramm and Spencer C. Sorenson
Laboratory for Energetics
Technical University of Denmark
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to investigate some of the various theories for 3. Intake and exhaust ports are constant pressure
hydrocarbon emission formation by comparing model reservoirs.
predictions with experimental results. Earlier important 4. Intake and exhaust valve flow are isentropic with
model studies has been made by Daniel (5), Lavoie et. empirical flow coefficients.
al (6), Lavoie and Blumberg (7), Shyy and Adamson 5. There is no dissociation of the products of
combustion.
(8) and Dent and Lakshminarayanan (9).
6. Heat transfer is calculated through the use of the
since the engine used for the experimental was Woschni heat transfer correlation (10).
deposit free, and since the engine was operated far 7. The pressure is uniform throughout the
away from the flammability limits, the resulting model combustion chamber.
only contains the effects of mechanisms a) and b) 8. The combustion process is modeled through an
above. empirical equation for the rate of heat release.
9. The residual gases and the fresh charge in the
The purpose of this paper is to compare the previous
combustion chamber are completely mixed at all
measurements of hydrocarbon emissions with the times.
predictions of the simulation in order to evaluate the 10. Reverse flow gases through the intake valve
theories incorporated into the simulation model. In during overlap and at the end of the compression
order to investigate the general applicability of the stroke remain seperate from the incoming fuel air
model, the predictions of the model are also compared mixture in the intake manifold. The back flow is
to the independent experimental results of Lavoie and completely purqed from the intake manifold
Blumberg (7). before any new fresh charge enters the
combustion chamber.
MODEL The equations for the thermodynamic model are given
in Appendix 1.
The complete engine model consists of three
Calculation of the oil film temperature
submodels; a thermodynamic model for combustion
chamber gasses, a hydrocarbon formation model, and Since the solubility of fuel in the lubricant is
a post-flame oxidation model. The thermodynamic temperature dependent, it is necessary to know the
model calculates the physical and chemical conditions temperature of the lubricant film.
in the cylinder as a function of crank angle. The The temperature profile in the area of the wall is shown
hydrocarbon model calculates the amount of unburned schematically in Figure 1. The most
hydrocarbons in the cylinder as a function of crank
angle and calculates the respective contributions from
the oil film and the crevices. The post-flame oxidation
model is used to calculate the oxidation of the
hydrocarbons which appear in the bulk cylinder
gasses after the main combustion process is
completed, as well as oxidation in the exhaust port.
Termodynamic model
Basic Assumptions
The assumptions made in the development of the
model are the following:
1. The fuel is completely vaporized and has the
composition CnH2n and a mass specific heat
equal to that of ethylene.
2. All substances are ideal gases with temperature Figure 1. Temperature profile near the cylinder
dependent specific heats. wall.
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significant temperature drops occur in the boundary T w can be found from this expression by iteration in
layers of the combustion chamber gasses and the
coolant. It is therefore reasonable to assume that the the model, since A(t), h(t) and T(t) are calculated in the
temperature of the oil film and the cylinder wall are cycle simulation.
constant and equal.
The value of U was selected to agree with
Lavoie et. al., (6) have reported an average heat experimental results of Huls et. al. (12), which show
transfer coefficient, U , between the wall and the that Tw is about 30 K larger than the coolant
coolant over an engine cycle. Using the heat transfer temperature in the reference condition. This results in
coefficient, the heat transfer through the cylinder wall a value of U of 0,3 kW/m2-K instead of the value from
can be calculated as: (6), which was 1, 8.
φ = A ⋅ U ( Tc – Tw ) (1) The oil film temperature was set equal to T w , since
where: the temperature over the oil film was assumed to be
constant.
Tc is the coolant temperature
HYDROCARBON MODE
A is the average area in contact with the
cylinder gasses: Oil mechanism
2
∂c ∂ C
------ – D ----------- = 0 (5)
∂t 2
∂x
With the appropriate boundary conditions:
∂C
------- ( o, t ) = 0 (5a)
∂x
c(1, t) = F(t) (5b)
c(x, 0) = 0 (5c)
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p P 2
= ---- -------
p
=> X = ---- Y
2 H p H 2
where: X2 is the mole fraction of fuel in the oil,
p2 is the pressure of fuel in the gas phase
mixture,
H is Henry’s constant for the fuel disolved in
the oil,
p is the total pressure of the gas mixture.
Y2 is the mole fraction of fuel in the gas
mixture.
Using v1 and v2 as the number of moles of oil and fuel
in the liquid phase, and g2 and g3 as the moles of fuel
and other gasses in the gas phase, equation (6) can
be written:
Figure 2. Cross section of wall / oil film.
Then:
M
3
where: K = -------------------
*
H ⋅ M2
Using m to denote mass and M to denote molecular
weight: F(t) is known, since p(t) and Ym(t) are known from the
thermodynamic model, and H* is known from
experimental measurements (3, 4). M2 and M3 are the
molecular weights of the fuel and the complete fuel air
mixture respectively.
(5) can be written:
* M1
Since H = H ⋅ -------- and Ym is the mass fraction of fuel
M
2
in the gas phase.
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The rate of post-flame oxidation can be written in the assumed to be the entire cylinder volume.
following form:
The boundary layer is assumed to leave the cylinder
via the exhaust valve in the same proportion as that
portion of the total cylinder contents which leaves the
cylinder at a given time.
where [ ] denotes concentration in mol/cm3, A has the Plost-Flame Oxidation in the Exhaust Port.
units of (cm3/mol) a+b-1/s and E is in (cal/mol). T is the
temperature in K, while the gas constant R = 1,987 In a given amount of time, dt, a given mass, dm, is
cal/(mol K). CR is a calibration constant, which is used discharged from the cylinder. It is assumed that dm
to fit calculated results to experimental results. C R was passes through the exhaust valve without loss
chosen such that model calculations and experimental (isenthalpic), such that the temperature of dm at the
results agreed as closely as possible for a reference entrance to the exhaust port is the same as the
case. cylinder gas temperature at that time.
Table 1 shows for the constants as found in the
The flow through the exhaust part is assumed to be
literature.
plug flow, which means that an element, dl, with mass
dm passes through the port as a closed plug, without
mixing with neighboring elements. The element dl is
Reference Fuel A E a b assumed to contain the contents of the gasses which
(15) gasoline 7.7.1015 37230 1.0 1.0 flow through the exhaust valve over one degree of
crank rotation. The energy loss from the element is
(16) p-xylene 2.3.1014 45040 0.882 0.657
exclusively to the port wall. This situation is shown in
Figure 4.
Table 1. Constants used in the post-flame
oxidation model. An energy balance for element dl gives the following
equation, (7):
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Nu = 0,258.ReD0.8 (17)
SIMULATED RESULTS
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Figure 6. Hydrocarbon desorption from crevices and Figure 8. The simulated amount of hydrocarbons
oil film. desorbed from the oil film versus oil film
thickness.
crevice hydrocarbons will be oxidized after release into flame oxidation is not complete for released
the combustion chamber.
hydrocarbons. An additional 35% of the accumulated
hydrocarbons is oxidized in the exhaust port. This
Figure 7 shows the cumulative hydrocarbon
means that of the original 100% of the hydrocarbons
desorption from both the oil film and the crevice
volume. Post-flame oxidation stagnates around 600 which are released from the oil film and crevices, 30%
°CA, where the temperature is approximately 900 °C. appears in the engine exhaust gas.
35% of the hydrocarbons accumulated in the oil film
The simulated amount of hydrocarbons desorbed from
and crevices is oxidized in the cylinder after release.
the oil film is shown as a function of oil film thickness in
The lower curve shows the accumulated hydrocarbon
emission from the exhaust port. The exhaust valve Figure 8. Hydrocarbon desorption increases
opens at 460 °CA, but it is first at about 560 °CA that approximately linearly until an oil film thickness of
the post approximately 2 µm, after
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which there is no significant change. In the following, Minimum value of 0.4 % was used for oxygen
an explanation of the desorption mechanism is given. concentrations in rich mixtures. A doubling of this
value resulted in a decrease in the hydrocarbon
Figure 9 shows concentration profiles for the oil film’s
emission of 20% in rich mixtures.
top element during the pressure rise in the cylinder,
where most of the absorption of hydrocarbon in the oil COMPARISON WITH EXPERIMENTS -
film occurs. The oil film thickness in this case is taken BUKH ENGINE
to be 2 µm. The increase in concentration occurs
simultaneously with the pressure rise at about 320 - The first comparison between simulation and
340 °CA. At about 420 °CA, the concentration of experimental results will be made for a series of
measurements which the authors have made on a
hydrocarbons in the cylinder falls to 0 due to
BUKH single cylinder experimental engine (3, 4). The
combustion, which can be seen by the decrease of the results are compared to a reference condition, and
hydrocarbon concentration at the oil film/cylinder gas unless otherwise noted, comparisons are referred to
interface to 0 at that time. There will then be a these conditions. The reference condition is described
concentration gradient in the film at the right of the in Table 2.
maximum point of the curve and a gradient out of the
film to the left of the maximum. By 420 °CA there is
only a concentration gradient out of the film. This
means that at an early point in the process, a diffusion Parameter BUKH engine CFR engine
of hydrocarbon out of the film occurs. The diffusion out Speed - rpm 2000 1250
of the film and consequently the desorption is, Fuel-air equivalence ratio 0.9 0.9
therefore, quite effective and the final level before the compression ratio 8.0 7.0
Ignition Timing °BTC 25 35
gas phase concentration starts to increase again (720
Bore - mm 85 82.5
°KV) is quite low. In other words, the oil film is quite
Stroke - mm 85 114.3
effectively emptied of fuel hydrocarbon. Coolant Temperature *C 80 94
Fuel Iso-octane Isoo-octane*
Figure 10 shows corresponding curves for an oil film
Lubricant Oil C Oil B/C**
thickness of 5 µm. During compression, the oil film Exhaust Port Length - mm 75 160
contains significantly more fuel than in the previous Exhaust Port Diameter - mm 39 32
case, but the emptying of the film is not as effective, oxidation correction, CR 0.2 0.2
since for a long time after combustion, there are crevice volume - mm3 540 280
oil film thickness - µm 5 5
concentration gradients which lead to diffusion in both
Intake Pressure - kPa 74.5 ***
directions. This means that there is a larger amount of
Piston Temperature - °C 250 250
fuel in the oil film at the end of the engine cycle for an IMEP *** 380
oil film of 5 µm than with 2µm. In this case, a thicker oil ISFC *** 240
film does not result in increased desorption. Heat Transfer Coefficient
between coolant and cylinder
In the thermodynamic cycle simulation, it is necessary wall - kW/m2-K 0.3 0.3
to assume that even with mixtures which are richer
Table 2. Basis parameters for the simulation model
than stoichiometric, there is still some oxygen present
with the BUKH and CFR engines.
after combustion which can participate in post-flame
* Indolene used in experiments, iso-octane
oxidation. This is a result of chemical equilibrium,
data used for simulation
which is not included in the cycle simulation. ** Unknown oil used, this mixture is typical
Measurements of exhaust gas composition can be for commercial oils
used to give an indication of the amount of oxygen *** Variable on account of data presentation
present in the exhaust. In the model calculations a form
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Figure 14. Simulated results for variations in Figure 15. Oil related hydrocarbons in the exhaust gas
relative fuel-air ratio and ignition for variations in relative fuel-air ratio and
timing. ignition timing.
even though the general hydrocarbon level decreases. timing. As previously mentioned, the oil film
This can be seen in Figure 15, where the contribution contribution is not oxidized to the same extent as the
from the oil film in % of the total is shown as a function crevice contribution. In addition, the lower cylinder
of the equivalence ratio and ignition timing. This is pressure will also cause a significant reduction in the
related to the increased post-flame oxidation with the crevice contribution to the hydrocarbon emission.
retarded
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Effect of lubricant.
Lubricant B Lubricant C
Engine experiments have been conducted using two
Molecular weight ≈550 ≈550
different lubricants with iso-octane as fuel (3).
Lubricant B is a fully synthetic lubricant based on Density (kg/m3) at 15°C 864 961
polyalpha olifin, while lubricant C is a fully synthetic Viscosity (cSt) at 40°C 107 81.5
lubricant based on polyolester. Properties of the Viscosity (cSt) at 100° 18.1 13.7
lubricants are shown in Table 3. Viscosity Index 188 184
SAE classification 5W-50 10W-40
Figures 16-18 show the simulated hydrocarbon
emission for oils B and C as a function of fuel air ratio Table 3 - Properties of the lubricants used in the
and ignition timing. The fuel is more soluble in oil B investigation.
and the model therefore predicts higher hydrocarbon
emissions with oil B. By comparing the simulated
curves with the experimental results in Figure 19, it
can be seen that the predicted difference in emissions
with the use of different lubricating oils is of the same
size as the experimental results. The simulated results
show a slightly decreasing difference between
lubricating oils with decreasing fuel air ratio, which is
opposite that of the experimental results. The model
predicts a slightly decreasing difference because of a
decreasing fuel concentraton in the gas phase with
decreasing fuel air ratio and because of lower cylinder
pressure.
An explanation for the observed larger difference in Figure 17. As Figure 16, but ign 25 BTDC.
the effect of lubricant with leaner mixtures may be the
difference in oil film thickness for varying fuel air ratio.
For leaner mixtures, the viscosity of the oil will be
higher, because less fuel is disolved in the oil film. An
increased viscocity will result in an increased oil film
thickness, which can in turn cause increased
absorption and desorption of the oil
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film and consequently a larger contribution from the oil The lubricating used, when in equilibrium with a
film mechanism with leaner mixtures. mixture of air and xylene, in stoichiometric proportions
at atmospheric pressure will contain 1.8% xylene. For
Effect of fuel type
the corresponding conditions with isooctane, the
A comparison between predictions and measurements lubricating oil will contain only 0.3% isooctane. It is
for xylene as fuel is shown in Figure 20. The model possible that this concentration difference could cause
predicts hydrocarbon emissions which are too large. a significant reduction of the viscosity of the oil film
This is because xylene is very soluble in the lubricant when the engine is operated with xylene as fuel.
and the model predicts a large contribution to the
hydrocarbon emission from the oilfilm. The simulation shows that an oil film thickness of
There appear to be 3 possible explanations for this. about 1 µm will give results in good agreement with
First, it could be suggested that the oil film becomes the measured results for xylene.
saturated and that there is no absorption or
desorption. The model predictions show that this is not This explanation is also consistent with the
the case. Secondly, it could be suggested that there is experimental results where two different oils were
a difference in the rate of diffusion between iso-octane tested with isooctane. For richer mixtures, the
and xylene. Measurements of the diffusion coefficients hydrocarbon emissions from the two oils approach
show that the lubricant, but not the fuel, influences the each other. According to this explanation, more fuel is
diffusion coefficient. This is shown in Table 4. A third dissolved in the oil film for richer mixtures and
explanation; that when the fuel dissolves in the oil, it therefore the oil film thickness is reduced and the
lowers the viscosity and therefore reduces the oil film contribution from the oil film mechanism becomes
thickness, seems more likely. smaller with richer mixtures.
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Fuel
Xylene Lubricant
Isooctane
units: m 2/s
Effect of load.
The comparison between simulated and experimental Figure 21. Comparison between simulations
results is shown in Figure 21. Both the model and the and experimental results for varying
experiments indicate a decrease in hydrocarbon load.
emission with increasing load. The • Experiments
- Model
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Effect of fuel air ratio. calibration of the model did not consider the effect of
variations in either speed or load.
A comparison between simulated and experimental
results for the CFR engine is shown in Figure 22, Some of the earliest models, that didn’t include the oil
which corresponds to the comparison for the BUKH film mechanism, predicted an increase in hydrocarbon
engine shown in Figure 11. For the BUKH engine, the emissions with increasing engine speed, in contrast to
model gave a slope for the hydrocarbon emission experimental results. The present model correctly
predicts the decrease in hydrocarbon emissions with
which was too large for 0.95 < Φ < 1.00. For the CFR
increasing engine speed. This effect is due to the
engine, this slope is of the correct magnitude, and it
smaller amount of time available for the absorption
appears that the post flame oxidation is simulated
and desorption of the fuel components in the oil film
more accurately for the CFR engine. with higher engine speeds.
A significant difference with the CFR engine is that it is
more lightly loaded, which results in a lesser degree of CONCLUSION
post flame oxidation. This suggests that the model The complete simulation which is composed of a
better describes the post flame oxidation with lower thermodynamic engine cycle simulation, a
load. hydrocarbon formation model and a post-flame
The model otherwise correctly predicts the correct oxidation model, is able to predict hydrocarbon
level of hydrocarbon emissions in the exhaust gas, emission levels and trends for two different engines
although the calculated values are somewhat high for with different engine parameters, but with model
Φ > 1.0. For Φ ≈ 0.7 the hydrocarbon emissions start constants obtained from calibration with only the one
to increase again. This is not reflected in the simulated engine.
results, since the model does not consider bulk flame The model also correctly predicts trends in
quenching or misfire, which may occur near the lean hydrocarbon emission with changes in timing, fuel air
flammability limit. ratio, and load and speed.
Effect of ignition timing. The model indicates that the relative significance of
Figure 23 shows simulated and measured results for the crevice and oil film contributions is dependent on
varying ISFC. This was obtained by varying the spark engine construction.
timing. Larger values of ISFC were obtained by The predicted differences in hydrocarbon emission
retarding the timing. There is good agreement with different lubricating oils and iso-octane as fuel are
between the simulated and measured results. of the same magnitude as those observed
The decrease in hydrocarbon emission with increasing experimentally. The model predicts a slight decrease
ISFC is partially caused by the lower pressure which in the difference between the oils for leaner mixtures,
causes less collection and release from both the oil while the experimental measurements indicate a slight
film and the crevice volume and partially by the increase in the difference.
increased post flame oxidation caused by the higher While the model correctly predicts emissions levels for
exhaust temperature. isooctane, the predicted levels for xylene are
considerably higher than those measured. It is thought
Effect of engine speed.
that the higher concentration of xylene in the oil film
The comparison between simulated and measured could cause a decrease in the oil viscosity and
results is shown in Figure 24. The effect of engine therefore a decrease in the oil film thickness, which if
speed is not very large in either the simulated or the implemented in the model could cause a decrease in
experimental results. Again, the agreement is quite the predicted hydrocarbon emission. The oil film
good. This is encouraging, since the original thickness was assumed to be independent of all
engine parameters in the model.
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Figure 22. Comparison between simulations Figure 24. Comparison of simulations and
and experimental results for varying experimental results for varying
relative fuel-air ratio. engine speed.
• Experiments • Experiments
- Model - Model
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6. Lavoie, G. A., Lorusso, J. A. and Adamczyk, A. A. 15. Lavoie, G. A. "Correlations of Combustion Data
"Hydrocarbon Emission Modelling in for S. I. Engine Calculations-Laminar Flame
Reciprocating Engines". Symposium held at The Speed, Quench Distance and Global Reaction
General Motors Research Laboratories, Rates", SAE Paper no. 780229, SAE International
November 1978. Congress and Exposition, 1978.
7. Lavoie, G. A. and Blumberg, P. N. "A Fun 16. Elpern, D. Unpublished MS Thesis, Mechanical
damental Model for Predicting Fuel Consumption, Engineering Department, University of Wisconsin,
NOx and HC Emissions of the Conventional 1970.
Spark-Ignited Engine". Combustion science and
Technology, vol. 21, pp. 225-58, 1980.
180
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Subscripts:
o = before combustion
i = intake valve
e = exhaust valve Where: AV = time dependent valve area
f = fuel
r = residual CD = flow coefficient
· = flow rate per degree crank angle
Heat Release Model m
Where:
·
Q APP = apparent heat release rate
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This paper is subject to revision. Statements and Persons wishing to submit papers to be considered
opinions advanced in papers or discussion are the for presentation or publication through SAE should
author’s and are his responsibility, not SAE’s; send the manuscript or a 300 word abstract of a
however, the paper has been edited by SAE for proposed manuscript to: Secretary, Engineering
uniform styling and format. Discussion will be printed Activity Board, SAE.
with the paper if it is published in SAE Transactions.
For permission to publish this paper in full or in part, Printed in U.S.A
contact the SAE Publications Division.