Beruflich Dokumente
Kultur Dokumente
Open Access
Comparison Between Simulations of Real and Ideal LRE Combustion of
LO2-CH4
A. Minotti* and C. Bruno*
Department of Mechanics and Aeronautics, University of Rome “La Sapienza”, Via Eudossiana 18, 00184, Rome, Italy
Abstract: This work is a contribution toward better understanding of the impact of real gas behaviour on injection,
mixing and combustion in future Liquid Rocket Engines. Recent US and EU patents indicate that work is already
underway in this key area, and is suggestive of potential breakthroughs in injector design. To this purpose, three
simulations of coaxial LO2/CH4 Liquid Rocket Engines injector flames at supercritical conditions and at 1.18 equivalence
ratio are presented. Real and ideal gas properties are used to investigate differences. Properties have been calculated or are
from experiments, and are fitted by 6th order polynomials and introduced in the computational software. An Eddy
Dissipation Model describes the turbulence-chemical kinetics coupling. Two of the three simulations are carried out at
15MPa. Two of them assume real gas properties while the other assumes ideal gas behaviour. The O2 and CH4 injection
temperature is assumed supercritical. Simulations performed predict that, due to compressibility, pressure is not uniform
inside the combustion chamber; therefore one more simulation was carried out using real gas properties at the highest
pressure found inside the combustion chamber, i.e. at 16.5MPa. Because the Reynolds numbers of the real gas are lower
than those for ideal gas, the real gas potential core lengths are predicted longer than in the ideal case, while maximum
temperatures are substantially lower due to the different specific heats behaviour. These results show that using real gas
properties as accurately as possible is a key issue in the preliminary design of LRE injectors and combustion chambers,
and may lead to innovative new cryogenic injectors and in the future new patents.
Keywords: Supercritical conditions, LO2-CH4 liquid rocket engines, combustion, thermophysical properties.
2) Whether thermophysical properties must be described appeared. Among the most recent works are those of Ruiz [29]
as local functions of T and P, or they can be described and De Giorgi [30]. The first analysis is a 3-D non reactive
as function of T only and at a fixed [design] pressure. flow with LES using 5.5M cells; the most important result is
This that is possible, it would reduce implementation the transcritical-supercritical potential core length comparison.
in CFD codes and CPU times, while maintaining It shows that in the supercritical regime the potential core
physical accuracy. This second question bears on length is shorter than that transcritical. Our work (below)
LRE operation as well as on its simulation. shows that the result is due to the different Reynolds numbers,
and in particular to the different viscosities at the two inlet
Accordingly, three reacting LO2/CH4 simulations of a
conditions (keeping the mass flow inlet fixed, the Reynolds
generic coaxial LRE injector, were carried out, see Table 1,
number is a function only the viscosity). The second work
and their results are discussed in the next sections. Predicting
mixing and combustion downstream of a single coaxial deals with a reactive flow of LOX and CH4 at 150 atm and
compares the effects of assuming ideal and real properties
injector element is of primary importance because, for
using the Peng-Robinson real gas equation. Because results
almost all of the injector near region, each injector operates
are obtained for fixed inlet velocity (not fixed mass flow rates,
independently of others, and the general picture of the
as done in the present work), the heat release changes and
overall reacting flowfield in a LRE may be interpreted as a
affects the comparison.
collection of many coaxial injector flames.
Injection Temperature
Simulation Design Pressure Properties Prediction Pressure Gas Model
CH4 O2
From Table 1, two pressures are assumed (15MPa, This field is still evolving, and more information on the
16.5MPa); this because real gas properties are function not differences between the two regimes will certainly become
only of temperature (as in ideal gases) but also of pressure available in the future. In contrast, experimental data for
[12]. The CFD code used in these simulations (FLUENT reactive flows would be more than welcome, but seem still a
6.2.16) cannot accept properties as functions of temperature long way off because of the forbidding LRE environment.
and pressure simultaneously, so the following strategy has
been implemented: besides those at the nominal P=15MPa, MODELLING DETAILS
the third simulation was carried out using real gas properties A summary of the three simulations of LO2/CH4
predicted at 16.5MPa, the highest pressures found in the axisymmetric coaxial jets combustion is presented. All use
combustion chamber at the nominal pressure of 15MPa. In the same geometry (see Fig. 3), computational mesh (512000
this way it was hoped to bracket LRE combustion behaviour cells) and boundary conditions: mass flow imposed at inlet,
due to the effect of pressure on real gas physics. constant temperature on the walls except for the post tip,
Table 2 reports the critical conditions of the four species which is adiabatic and constant pressure at the outlet.
assumed in the present reacting simulations. The CH4 and O2 jets are supercritical. Simulations were
Table 2. Critical Properties of Species Assumed of Interest to carried out using steady state Favre-averaged Navier-Stokes
LO2/CH4 LRE (FANS) equations; turbulence was modelled by a k- model.
Real properties have been described by means of 6th order
polynomial fits [11] as function of temperature and
Tc [K] Pc [atm] calculated at the pressure values reported in Table 1.
O2 154.6 49.8 These polynomials are based on:
CO2 304.2 72.8 1. Experimental data (from NIST tables [31]), where
H2O 647.3 217.6
possible, and data obtained with the Lee-Kesler [32]
equation of state (EOS), for what concerns density
CH4 190.4 46 and Cp. The choice of the EOS based on L-K22 is the
result of a comparison between the EOS by Lee-
Kesler [32], Soave [33], Redlich-Kwong [34] and
In literature there are some examples of simulations of non Peng-Robinson [35] made in [12, 36] and of the
reacting and reacting flows at subcritical and supercritical analysis of Harstad et al. [37]. The comparison
conditions, but most of them are for LOx/H2 propellants: see, indicated the Lee-Kesler EOS fits the NIST data [11,
for instance, Chehroudi [13,14], Mayer and Tamura [15-18], 37] (especially in the lower and upper range) better
Oefelein and Yang [19-23] and O’Kongo, Harstad, and Bellan than all other EOS, its penalty being a longer
[24,25]. Only recent experimental [26,27] and numerical [28] computational time. Fig. (1) provides, among the
papers on LOx/CH4 mixtures at transcritical conditions have
Comparison Between Simulations of Real and Ideal LRE Combustion of LO2-CH 4 Recent Patents on Space Technology, 2010, Volume 2 3
thermophysical properties, the methane density The “Ideal” simulation was carried out using the ideal
behaviour, as function of temperature, with the P
experimental data and Lee-Kesler data highlighted. gas equation of state = 1 , Cp’s were predicted using the
RT
2. Experimental data (from NIST), where possible, and same polynomial fits in CEA 400 [45-48] (introduced in the
data obtained with the Chung et al. method [38], for CFD software using 6th order polynomials [11]) and
what concerns viscosity and thermal conductivity. viscosity and thermal conductivity were calculated using gas
The choice of this method is the result of a kinetic theory (equations 1 and 2) [49, 50]:
comparison between this method and that of Ely and
15 R 4 C pi M w i 1
Hanley [39] also made in [12, 36]: this comparison ki = μ i + ; (1)
indicated that Chung et al. fits the NIST [11, 31] data 4 M w i 15 R 3
better. Fig. (2) provides, among the transport
properties, the methane viscosity behaviour, as M wiT
μ i = 2.6 106 ; (2)
function of temperature, with the experimental data μi i 2
and Chung et al. data highlighted.
The last step has been the introduction of one single
The polynomial fits have been introduced inside a CFD global reaction, i.e.:
code (FLUENT 6.2.16) and validated [12] by simulating and
comparing the experimental results of a single jet of N2, in a CH4+2O2 CO2+ 2H2O (3)
quiescent N2 chamber, injected both at supercritical The crude kinetics of (3) overestimates maximum
temperature and at subcritical temperature [40, 41]. After temperature; therefore the heat of reaction was appropriately
validation, two LO2/CH4 non-reacting coaxial jet modified by correcting the methane formation enthalpy, so
simulations, at sub and supercritical conditions, have been H’fCH4=-1.3108 [J/kmol], see reference 2 for details.
carried out [12] and studied [13]. Results as potential core
The turbulence-chemistry coupling was modelled by
and jet spread angle have been compared with those from
means of an Eddy-Dissipation concept [51-56] in which the
Villermaux theory [42, 43] and with those in [44], showing
source term (Ri) of the i-specie production is:
good agreement [12] especially for the simulation performed
at subcritical conditions. Villermaux theory has been eps Y
developed for coaxial water-water jets, much closer to Ri = 'i M w,i A min ' (4)
subcritical than to supercritical conditions. K i M w,
500
where Y mass fraction of the reactant ; A empirical
450 eps
constant, 4.0; inverse of turbulent time scale; ’i,r
400
K
350
experimental data
Lee-Kesler equation
stoichiometric coefficient of the i-th species.
CH4 density, kg/m3
300
The key assumption of this model is that chemical times
250
are shorter than those of turbulence, and thus that each
200 reaction rate is controlled by the velocity of turbulent
150 mixing.
100
This condition was verified by calculating inside the
50 recirculation zone the turbulence time (/), which turned
0 out to be 10-4 s, while chemical times for a methane-oxygen
0 1000 2000 3000 4000
temperature, K
5000 6000 7000
reaction are reported in Table 3. Chemical times were
separately predicted by simulations with the CHEMKIN
Fig. (1). CH4 density: experimental data and extrapolation. code [57] using a CH4/O2 perfect stirred reactor detailed
0.0002
reaction mechanism at the same design pressure of the LRE,
i.e. 15MPa.
0.00018
0.00012
0.0001
Temperature [K] Times [s]
0.00008
1100 3.1 104
0.00006
0.00004
1300 2 10 5
temperature, K
Fig. (3) reports a part of the domain and the structured
Fig. (2). CH4 viscosity: experimental data and extrapolation.
mesh. The oxygen inlet duct thickness is 0.0035m while the
methane inlet duct thickness is 0.0011m and the post tip is
4 Recent Patents on Space Technology, 2010, Volume 2 Minotti and Bruno
0.0004m. Inlet ducts length is 0.005m while the entire Table 4. Supercritical Case: Input Data, REAL and IDEAL
chamber is 0.105m.
Properties REAL IDEAL
Injection Zone Combustion Chamber
Oxygen Injection Temperature [K] 300 300
CH4
Injector Oxygen Density [kg/m ] 3
203 192
Oxygen Mass Flow [kg/s] 0.386 0.386
O2
Injector Oxygen Velocity [m/s] 49.4 m/s 52.2
-5
Oxygen Molecular Viscosity [kg/m-s] 2.7410 2.610-5
Oxygen Post Tip Oxygen Reynolds number 2.52106 3.41106
Fig. (3). LO2/CH4 schematic diagram of the computational domain. Oxygen Compressibility Factor, Z 0.94 1
Fig. (4) provides the wall unit x value at the first point + Oxygen Isobaric Specific Heat [J/kg K] 1166.3 918.3
along the oxygen post-tip; this is useful to highlight the level Methane Injection Temperature [K] 300K 300K
of accuracy obtained [58, 59]. This figure shows that the first
Methane Density [kg/m3] 117 96
point is among 0.02 and 0.7 wall units, and that x+<1,
assuring physically realistic grid resolution. Methane Mass Flow [kg/s] 0.114 0.114
Methane Velocity [m/s] 37.6 38.3
0.8
-5
Methane Molecular Viscosity [kg/m-s] 1.2310 1.1210-5
0.7
0.6
Methane Reynolds number 3.03105 3.31105
post tip, m
O2 CH4
Fig. (4). Post-tip x+.
Velocity 6.2 % 16.97 %
SUPERCRITICAL CH4 REACTING WITH
SUPERCRITICAL O2: REAL VS IDEAL GAS Molecular Viscosity -33 % -9.8 %
PROPERTIES RESULTS (SIMULATIONS 1 AND 2) Density -5.7 % -8.3 %
Simulations 1 and 2 deal with methane and oxygen both Reynolds number 26.4 % 8.7 %
injected at supercritical temperature and pressure. Ideal and Isobaric Specific Heat -27 % -51 %
real gas properties are used and results are compared. Real
gas properties were calculated at the nominal design
pressure, i.e. 15MPa. Operating conditions are reported in 2500
Table 4 for both cases: note values for the compressibility
O2 Isobaric Specific Heat, J/kgK
2300
factor Z equal to 0.948 for the oxygen and 0.824 for the
methane (in ideal gases Z is equal to 1). 2100
Ideal
Table 5 reports reactants percentage differences between 1900
Real
real and ideal properties i.e. (((ideal-real)/ideal)*100) of 1700
reactants: a negative value means that the real property value
1500
is greater than the ideal one. The comparison has been
carried out by keeping fixed the reactants flow rates at inlet 1300
and their injection temperatures, in order to have identical 1100
heating values and Reynolds numbers function only of
900
viscosity.
700
Table 5 shows that differences are important, especially
80 280 480 680 880
as far the isobaric specific heats and the Reynolds numbers; Temperature,K
in particular real Cp are greater than ideal ones (Figs. 5, 6),
while the opposite is true for the Reynolds numbers. Fig. (5). O2 ideal and real isobaric specific heat, comparison.
Comparison Between Simulations of Real and Ideal LRE Combustion of LO2-CH 4 Recent Patents on Space Technology, 2010, Volume 2 5
These facts help to understand: Table 6. Ideal and Real Gas Properties: Results Comparison
1. the real potential core length is longer than ideal (see
Fig. 9 and Table 6); it means that turbulent mixing is Ideal Real
enhanced in the ideal case, in fact ideal propellants
Reynolds numbers are greater than ideal; Maximum Temperature 4320K 3770K
2. the ideal maximum temperature is greater than real Oxygen mass fraction at the exit plane 0.915 0.94
(4320K vs 3770K, see Table 6); this result is Maximum Pressure 16.9MPa 16.4MPa
confirmed also by Figs. (7, 8) which provide the
Jet spreading angle 1.41 1.47
radial temperature at different axial sections for the
real and ideal cases.
4900 Figs. (9-12) show temperature maps in the ideal and real
CH4 Isobaric Specific Heat, J/kgK
case; in particular Figs. (9, 11) report a zoom near the post-
4400
tip, where the flame anchors, while Figs. (10, 12) provide the
Ideal
3900 entire domain.
Real
3400
4.32e+03
2900 4.11e+03
3.91e+03
2400 3.71e+03
3.51e+03
3.31e+03
1900 3.11e+03
2.91e+03
1400 2.71e+03
2.51e+03
2.31e+03
900 2.11e+03
1.91e+03
90 190 290 390 490 590 1.70e+03
Temperature, K 1.50e+03
1.30e+03
1.10e+03
Fig. (6). CH4 ideal and real isobaric specific heat, comparison. 9.01e+02
7.00e+02
4.99e+02
4000 2.98e+02
3500 x/d=1
x/d=11 Fig. (9). Ideal Temperature map: zoom near the post tip.
3000
x/d=13
Temperature, K
2500 x/d=3
4.32e+03
x/d=5 4.11e+03
2000 x/d=7 3.91e+03
3.71e+03
x/d=9 3.51e+03
1500 3.31e+03
3.11e+03
2.91e+03
1000 2.71e+03
2.51e+03
500 2.31e+03
2.11e+03
1.91e+03
0 1.70e+03
1.50e+03
0 0.001 0.002 0.003 0.004 0.005 1.30e+03
Radius, m 1.10e+03
9.01e+02
7.00e+02
Fig. (7). Real gas: radial temperature at different axial sections. 4.99e+02
2.98e+02
4000
x/d=7 3.45e+03
2500 3.28e+03
x/d=9 3.10e+03
Fig. (8). Ideal gas: radial temperature at different axial sections. Fig. (11). Real Temperature map: zoom near the post tip.
6 Recent Patents on Space Technology, 2010, Volume 2 Minotti and Bruno
3.80e+03
pressure simultaneously. Table 7 reports the operating
3.63e+03
3.45e+03
conditions.
3.28e+03
3.10e+03 1.75E+07
2.93e+03
2.75e+03
2.58e+03
2.40e+03
1.70E+07
2.23e+03
2.05e+03
1.88e+03 1.65E+07
1.70e+03
Ideal
Pressure, Pa
1.53e+03
1.35e+03 Real
1.17e+03 1.60E+07
1.00e+03
8.24e+02
6.49e+02
1.55E+07
4.74e+02
2.99e+02
1.50E+07
1 axis, m
0.99
Fig. (14). Axial pressure: Ideal gas vs Real gas.
0.98
Table 7. Input Data
O2 mass fraction
0.97
Ideale
0.96
Reale
0.95
O2 CH4
0.94
Exhaust Pressure [MPa] 15 15
0.93
Calculation Pressure of real Gas properties [MPa] 16.5 16.5
0.92
respectively, at 15MPa; the third repeats the first, but using combustion chamber: this is the effect of the enhanced
real gas properties calculated at the highest pressure compressibility at supercritical pressure. The resulting higher
predicted inside the combustion chamber, i.e. 16.5MPa, in density yields lower flowfield acceleration., so a third
order to bracket the LRE supercritical combustion behaviour. simulation was performed to check how much this non-
uniformity affects the original assumption of constant
1.66E+07
nominal pressure inside the combustion chamber and to LRE
1.64E+07 combustion behaviour.
1.62E+07
Results show that, at supercritical conditions, predictions
1.60E+07
can be carried out using properties calculated at the nominal
Pressure, Pa
[53] Magnussen BF. On the structure of turbulence and a generalized [56] Westbrook CK, Dryer FL. Simplified reaction mechanisms for the
eddy dissipation concept for chemical reaction in turbulent flow. oxidation of hydrocarbon fuels and flames. Comb Sci Technol
19th Aerospace Science Meeting, AIAA, St. Louis, Mo., 1981; 42: 1981; 27(1-2): 31-43.
1-8. [57] CHEMKIN Software, Ver. 3.7. Comprehensive chemical kinetics.
[54] Magnussen BF, Hjertager BH. On mathematical modelling of USA, Elsevier's Science & Technology publishing 2004.
turbulent combustion with special emphasis on soot formation and [58] Spalart RP. Direct simulation of a turbulent boundary layer up to
combustion. 16th Symp. on Comb, the Combustion Institute, R=1410. J Fluid Mech 1988; 187: 61-98.
Pittsburg, 1977; 719-29. [59] Kim J, Moin P, Moser R. Turbulence statistics in fully developed
[55] Spalding DB. Mixing and chemical reaction in steady confined channel flow at low Reynolds number. J Fluid Mech 1987; 177:
turbulent flames. 13th Symp On Comb, The Combustion Institute, 133-66.
Pittsburgh, 1971; 649-57.
Received: July 15, 2009 Revised: September 9, 2009 Accepted: October 7, 2009