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Numerical Modeling of Two Dimensional SM
Numerical Modeling of Two Dimensional SM
Numerical Modeling of Two Dimensional SM
A mathematical model along with a numerical solution procedure is presented for the simulation of flameless
combustion (smoldering) of a solid in a stream of air. By assuming a global single-step combustion reaction,
the problem is formulated via conservation equations of mass, species, linear momentum, and energy.
Conservation equations are developed by volume averaging the microscopic conservation equations of the
constituent phases (i.e., gaseous mixture, solid fuel, and ash). The model accounts for conduction in the solid,
thermal radiation from the solid, and forced and natural convection flow and heat transfer in the gas stream.
Also included in the problem formulation are the effects of transport processes such as
the heatup and ignition of the solid sample, the smoldering of the solid, the motion of the burning front,
and the formation of ash and transport of gas and heat in it. The transient two-dimensional governing
equations of the problem, in terms of primitive variables, are discretized over nonuniform control-volumes
and solved by an iterative numerical procedure. Different aspects of the model and solution procedure are
also discussed. As a test problem, the smoldering of standard samples of charcoal (wood-coal) in a limiting
oxygen index (LOI) flammability test apparatus is modeled. The results of the smoldering simulations are
presented in terms of the field variations of velocity, composition, and temperature of the gas in the test
chamber, the temperature distribution in the solid and ash, and the temporal position and velocity of the
smoldering/burning front. The calculated transient burning rates are compared with the experimental data
obtained in a LOI apparatus.
multiplicity of transport processes with differ- transport mechanisms (e.g., diffusion and con-
ent length scales and scaling relationships. The vection of energy, oxygen, and volatiles) in the,
effective thermal models, therefore, have lim- solid, char, ash, and gas. This model is based
ited application for assessment of fire hazards, on a continuum solid/gas hypothesis at the
mainly because (1) they are geometry/ subparticle scale of the solid fuel, but consid-
configuration dependent, (2) they require input ers the simultaneous existence of species and
data that cannot be easily made apparatus temperature gradients on the solid-particle
independent, and (3) their use is questionable scale and on the reaction-front scale. The com-
due to the scaling issues mentioned above. plexity of the resulting equations has made the
Smoldering is another important mode of general case intractable, and the model is not
solid combustion that has motivated exten- solved. But by nondimensionalizing the govern-
sive experimental and analytical research in ing equations, it is demonstrated that the
the context of fire safety. Defined as a self- problem may be governed by as many as 55
sustaining exothermic heterogeneous oxidation dimensionless groups, and simplifications are
of the solid, smoldering combustion has been recommended for the limiting cases of small or
modeled more explicitly in terms of the intrin- large values for certain dimensionless groups.
sic properties of the solid, as compared with The present article is concerned with the
flame spread models. Using simplified kinetic formulation of a phenomenological model and
models, referred to as "global kinetics," initia- the development of a two-dimensional numer-
tion of smoldering process has been studied ical solution procedure that relates the intrin-
quite extensively from the thermophysical point sic thermophysical properties a solid fuel
of view [8-10]. These studies are based on to its behavior under smoldering condi-
one-dimensional models of solid degradation tion. The chemical mechanisms are simplified
in which the heat and mass transfer effects in through the use of apparent kinetic parameters
the gas phase are either neglected or treated (determined typically by the~xnal analysis, i.e.,
empirically [10]. Propagation of the smoldering DSC and TGA). In addition to the continuum
front subsequent to ignition is considerably solid/gas assumption of Ohlemiller [2], local
more complex, and much less studied analyti- thermodynamic equilibrium is also assumed, so~
cally. Experimental results of Ohlemiller [17, that one set of conservation equations for the
18] indicate the importance of gas-phase trans- entire domain may be developed by volume
port processes in the smoldering of permeable averaging the microscopic conservation equa-
fuel layers [17] and in forward and reversed tions of the constituent phases (i.e., gaseous
smoldering in the presence of a forced flow mixture, solid fuel, and ash). Included in this
[18]. The available analytical/numerical mod- formulation are the effects of transport pro -'
els [9, 10, 19, 20] cannot describe these effects cesses such as heatup and ignition of the solid
quantitatively. The transition from smoldering sample, combustion of the solid via a heteroge-
to flaming is still more complex, and has not neous exothermic reaction, motion of the
been modeled in any detail. The additional burning front, formation of ash and transport
complexity stems from the simultaneous pres- of gas and heat in it, conduction in the solid,
ence of heterogeneous and homogeneous reac- thermal radiation from the solid surfaces;
tions, which makes the couplings between the and forced and natural convection flow and
chemical reaction and heat generation, and heat transfer in the gas stream. The transient
transport of heat and gaseous species more two-dimensional governing equations of the
intertwined. Therefore, a realistic descrip- problem, in terms of primitive variables, are
tion of transition from smoldering to flaming discretized over nonuniform control-volumes
would require consideration of the thermo- and solved by an iterative numerical proce-~
physical and chemical processes present, and dure. The inputs of the numerical scheme are
the coupling between them. the intrinsic thermophysical properties of the
A thermophysical model for smoldering material, its char and ash, as well as the exter-
combustion propagation has been formulated nally imposed ignition and gas flow conditions.
by Ohlemiller [2] that accounts for various The numerical scheme calculates the field vari-
MODELING OF TWO-DIMENSIONAL SMOLDERING 173
ations of gas velocity, temperature, and compo- Among the independent parameters of the
sition, the transient smoldering rate, and the problem are the solid geometry and its thermo-
oxygen concentration limit for the sustaining physical properties, its chemical kinetics, and
of the smoldering process. the temperature, velocity, and composition of
The paper presents the results of the simula- the free stream gas. Obviously, not all of ]these
tion of smoldering of a cylindrical specimen of mechanisms and parameters are expected to
wood-charcoal under limiting oxygen index have significant influence on combustion ]char-
(LOI) test conditions [21, 22]. The model and acteristics of different solid materials 9 n d e r
solution procedure are validated by comparing various fire conditions. In the context c/f this
results of these simulations with the corre- work, smoldering combustion is referred to
sponding LOI measurements. Among the for- heterogeneous oxidation of a solid fuel by
malized tests, the LOI configuration is chosen direct attack of oxygen on the fuel surface.
for its simplicity, and availability of the test Moallemi et al. [23] provide a more detailed
apparatus. The methodology is currently being and generalized formulation that accOunts
applied for simulations of more accepted fire for the presence of both heterogeneou! and
tests (e.g., cone calorimeter [14], and heat homogeneous reactions, and has broader
release rate apparatus [15]), and the results applications.
will be presented elsewhere [23]. The smoldering of a cylindrical solid sample
The present article is the first to develop and placed axisymmetrically in an upright position
solve a general two-dimensional model for on a support at the center of a cylindrical
smoldering combustion that considers all the chamber is considered, see Figs. 1 and 2. The
relevant transport processes in detail along problem is transient and two-dimensiona! (r -
with the global chemical kinetics. This model, x) due to angular symmetry. The comPuta-
which is a powerful and useful tool for engi- tional domain, as shown in Fig. 2, is heteroge-
neers and scientists to evaluate smoldering neous and consists of solid, fluid (vap0r/gas
combustion, forms the major contribution of mixture or liquid), and fluid saturated porous
the work presented here. In contrast with pre- media (i.e., the ash and char). For numerical
vious models that use data from a given experi- convenience it is desirable to cast the gOvern-
ment to develop correlations for the same ing equations of the problem in different
experiment [3-7, 11-13], the present model regions of the domain into a similar form. To
uses intrinsic properties of the materials eval-
uated by different measurements and then
relates these properties of the solid fuels to
their smoldering behavior under different con- I
I~ Outlet Diameter
ditions. Since the sole emphasis is on model 1
development and validation, parametric studies I
i
are not presented here. i
I
Glass Chamber
FORMULATION I
Chamber I
x ~/ax-O.
v-O. reaction is assumed,
C(s ) + O 2 ( g ) -'-> C O 2 ( g ).
aged gas velocity vector, and e ug is the Both radial and axial conduction are
Darcian gas velocity. The equations are accounted for in all regions and all phases; but
expressed in terms of void averaged gas veloc- convective heat and mass transfer are via
ity to permit their use in all regions by varying gas/fluid only, since the velocity of the solid is
the value of porosity. The second term on the assumed to be zero. The preheating and igni-
right-hand side of Eq. 3 is often called tion is modeled by imposing a constant radia-
Brinkman's extension, and accounts for the tive heat flux q'i'gni at the top surface of the
macroscopic viscous shear in the liquid. The solid for a prescribed ignition period. The
value of the effective viscosity in Brinkman's radiative heat loss q'r'a~t is the energy exchange
extension is taken equal to the fluid viscosity between the solid surface and the chamber
[26]. The third and fourth terms on the right- wall at T~, since the gas is assumed to be
hand side of the momentum equation are nonparticipating. Therefore, the heat flux ierms
Darcy's term and Forchheimer's expression, vanish everywhere except on the surfaces of
respectively [25, 26]. These are empirical the solid and ash. In the numerical manipula-
expressions to account for the first- and tion of Eq. 6, the heat flux terms are converted
second-order drag forces, respectively, between into volumetric heat sources or sinks by !divid-
the fluid and the solid matrix. The permeability ing them by the appropriate control volume
of the porous medium K is calculated from sides in the solid or ash.
the Kozeny-Carman equation [25], The equation governing the transport of
species 0 2 and CO2 can be written as
d2e 3
K(E) - 1 7 5 ( 1 - e) 2' (4) 0
-7(EO Yo2) + v" (,pgUyo )
where d is the mean diameter of the parti-
cles constituting the porous media. For the = V.(EpgDeffVYo2 ) -- 0/1/~g, (8)
"inertia" coefficient B in Forchheimer's exten-
sion, the value given by Ergun [25] is employed:
0--~(EpgYco2) + V" ( ¢augYco2)
1.92
B (175E3),/2. (5) = V'(¢pgDeffVYco2) + 0/211~Ig, (9)
The volume averaged energy equation at any where Yo2 and Yco2 are mass fractions of 0 2
point in the computational domain can be writ- and C O 2 , respectively, Deff is the effective
ten as species diffusion coefficient which is assumed
to be the same for all the species in the gaseous
mixture, and 0/1 = 32/12 and 0/2 = 44/!12 are
cgt[(,pgCpg + (1 - e)psCp,)T] molecular mass ratios. The coupling between
+ V " (f.pgUgCpgT)
Eqs. 8 and 9 may cause numerical oscillation.
To accelerate numerical convergence, instead
= v . ( k o f f w ) + 6/-/Mg of solving Eq. 9, a solution for a mixturb mass
fraction,
+ V" q'(gni- V " qrad"
" (6)
0/9
In the above equation, cp is the specific heat, f = Yo~ + --~Yc%, (10)
0/1
and keff is the effective thermal conductivity of
the porous medium. Since the thermal conduc- is sought. The conservation equation for f is
tivities of the solid and fluid are not too dif- derived by combining Eqs. 8 and 9,
ferent, following Kansa et al. [19], the effective
thermal conductivity of the medium is modeled c~
by --~(Epgf) + V . ( e a u g f ) = V.(epgD~ffVf).
kef f = Ekg + (1 - E)k s. (7) (ll)
176 M. KARIM MOALLEMI ET AL.
chamber for examination of the ash and the The predictions of the numerical simulations
profile of the remaining charcoal. are also shown in Fig. 3 for comparison. These
The smoldering experiments revealed that results were generated for the set of parame-
the limiting oxygen index was 13.5% for the ters and properties listed in Tables 1 and 2.
specific wood-charcoal sample used. For lower Numerical simulations were performed for the
oxygen contents, the smoldering process could range of oxygen concentration that solid com-
not be sustained far after the time that the bustion was flameless. These were obtained
solid was ignited. The smoldering rate, evalu- after some adjustments in the heat of pyrolysis
ated from the instantaneous measurements of (2 x 10 7 < AH < 6 X 10 7 J/kg), activation
the ash-line, attained steady state values soon energy (8.0 x 107 < E < 9.0 X 10 7 J/kg-mol),
after the initial transient caused by the ignition and preexponent coefficient ( 1 0 9 _< Ap < 101l
and heat-up of the solid. During the smolder- s-l). The numerical predictions are in excel-
ing process, the ash always remained intact on lent agreement with the experimental results
top of the unburned solid, but occupied for the reaction parameters shown in Table 2.
80%-85% of the original solid volume, as No simulation was performed for oxygen con-
measured from the tip diameters of the origi- centrations beyond 40% where the smoldering
nal solid sample and its ash. The unburned process was close to the transition region and
solids had sharp conical profiles, with the cone the model, which is developed for hetero-
half-angle (measured from the centerline) geneous smoldering reactions only, was not
increasing from about 10° at 15% 0 2 to about appropriate.
25° at 60% 0 2. The variation of the steady Figure 4 shows the field variation of porosity
state smoldering rate/speed with oxygen con- under steady state smoldering condition for
centration is shown in Fig. 3. Figure 3 indicates different values of oxygen mass fraction at the
a gradual (nonlinear) increase in the smolder- inlet. The clustered contours in the solid indi-
ing speed with an increase in the oxygen con- cate a thin conical burning front. The cone
tent of the incoming gas mixture. For oxygen angles of the burning fronts evaluated from
concentrations above 73%, the solid burned figures like Figs. 4a-4c are in very good agree-
with a small but visible flame. However, above ment with the experimental results. Both the
55% the experimental data showed deviation numerical and experimental results indicate an
from the trend established in the smoldering increase in the burning front cone angle with
region, Fig. 3, indicating the possible onset of a an increase in the oxygen concentration.
transition region (e.g., undetectable colorless
flame proceeding observable flaming).
5.0
= Experimentdata
• Numerical data
o°°t
4.0
._c
~ ~ Regionof smoldering
3.0 ~n
-_~ o
a
~ ~ ° "6
_g
2.0 "6
C[:
.°
g- o
r (a)
r (b)
r (c)
0.0 i i - =' ' / i i , , I , , , , 1 , , , ,
25 50 75 100 Fig. 4. Field variation of porosity at constant smoldering
OxygenConcentration( % ) rate for different inlet oxygen mass fractions: (a) Yo2 = 0.2,
Fig. 3. Experimental data and numerical results for steady (b) Yo2 = 0.3, (c) Yo2 = 0.4, seven equally incremented
smoldering speed versus input oxygen concentration. contours between % = 0.3 and ~ash 0.9 are shown.
=
MODELING OF TWO-DIMENSIONAL SMOLDERING 179
Numerical Results
the smoldering simulation are shown in Fig. 6.
In this section, more comprehensive informa-
The figure depicts the gradual heatup 0f the
tion generated from the simulation of the
unburned solid and the cooling of the ash, with
smoldering of the charcoal sample under the
the maximum temperature on the burning front
conditions of Table 1 is presented. The param-
at or near the centerline. The temperafure of
eters of Table 2 are used with 20% constant
the solid support changes only when the' burn-
oxygen mass fraction at the inlet. Figure 5
ing front gets close to it. The corresp0nding
presents velocity field in the test chamber at
field variations of oxygen mass fraction are
three different times after the solid is ignited.
shown in Fig. 7. The constant mass f~action
The velocity field is much stronger near the
lines are clustered near the burning froat, and
smoldering solid, indicating the significant con-
the figures indicate to the diffusion of 9xygen
tribution of thermal buoyancy in defining the
in the ash and to a lesser extent in the solid.
gas flow in the test chamber. The thermal
The field variations of the porosity are pre-
buoyancy accelerates the gaseous mixture over
sented in Fig. 8 for different times in the
the solid and ash, and the hot combustion
smoldering simulation. The clustered contours
products being ejected out of the ash also help
indicate a thin burning front that develops with
to increase the magnitude of the maximum
velocity above the solid to more than ten times
the inlet velocity. The strong influence of
buoyancy in defining the flow near the smol-
/ A
9
1205.0
1105.0
/
e i000.0
7 905.9o
dering solid confirms previous assessments that 6 805.9o
5 705.00
the LOI measurements are not very sensitive 4 (;os.oo
3 505.00
to the changes in the inlet gas velocity [32]. 2 40$.00
I 30S.00
The figures also show a very weak gas flow in
the ash, marking an approximate shape for the
burning front. The velocity fields remain simi-
lar to Fig. 5c at larger times if viewed with
respect to the burning front. This is intuitively
expected since the smoldering has attained a
constant rate and the flow is dominantly con-
trolled by the thermal buoyancy. (a) (c)
The temperature distributions in the test Fig. 6. T e m p e r a t u r e field for 20% oxygen inlet mass frac-
chamber, solid, and ash at different times into tion: (a) t = 0.42 min, (b) t = 1.4 min, (c) t = 5.2!min.
180 M. K A R I M M O A L L E M I E T AL.
1400 1.0
A 0.1~
0.177
8 o.lsS 1200
7 0.133 D.II
0 o.111
lOOO
0 O.Om
4 o.o07
~° B.ll
~ ~o 0,4
j J
0.2
200
0 I I ~ m I . . . . I . . . . I • ; ' m J . . . . O.0
10 20 30 40 50
T i t f t e ( Ilec. )
o.e
The initial rise in the t e m p e r a t u r e is due to the Fig. 9. Time history of porosity, temperature, and oxygen
heatup and ignition process (t < 10 s). During concentration at point A of Fig. 2b.
this time period, the porosity at this point in
the solid does not change, while the oxygen
concentration changes slightly as oxygen dif- is initially slow as indicated by the slope of the
fuses towards the burning front. The smolder- variation of e with time. This is followed by an
ing front reaches point A at t = 12 s after increase in the smoldering rate, accompanied
ignition of the sample, and the smoldering rate by a rise in temperature and drop in the oxy-
gen concentration. The rise in temperature
increases the smoldering rate while the drop in
the 0 2 concentration has an adverse effect on
it. The result is an almost constant rate of
smoldering at this point until all combustible
mass is consumed (t = 38 s) and porosity
reaches that of ash (e = 0.9). The maximum
t e m p e r a t u r e at point A is achieved a few sec-
onds after the burning front passed through it,
due to the conduction and convection heat
transfer from the just-passed burning front.
After the passing of the burning front, the
t e m p e r a t u r e at this point drops due to convec-
tive cooling, and concentration of oxygen
increases due to diffusion and in the absence
of a sink (the burning front).
(a) (b) (c)
The variations of temperature, porosity, and
Fig. 8. Porosity field for 20% oxygen inlet mass fraction:
(a) t = 0.42 min, (b) t = 1.4 min, (c) t = 5.2 rain, three concentrations of 0 2 and CO 2 over the cross-
constant porosity contours are plotted for % = 0.3, 0.6, section a - a of the solid, Fig. 2b, at t = 3.1 min
and 0.9. are presented in Fig. 10. At this time, the
MODELING OF TWO-DIMENSIONAL SMOLDERING 181
1400 1.0
50% reduction in the smoldering speed, mostly
1200
o.I
due to the reduction of oxygen convection and
diffusion towards the burning front.
o.s
| o .
1
O.2O
O~
shape of the burning front for different oxygen
concentrations at the inlet, compared weil with
the experimental measurements on standard
samples of wood-charcoal, The simulations also
o.10 generated information about the coupled and
o.7
sometimes competing heat and mass trans-
fer mechanisms that define the smoldering
o.0o0.° 0.o characteristics of the solid.
2.S s.O 7.5 10.0 12,$ 15.0
r(rnml
15. ASTM E 1354-90, Standard Test Method for Heat 25. Cheng, P., Advances in Heat Transfer (T. F. Irvine,
and Visible Smoke Release Rates for Materials Jr., and J. P. Hartnett, Eds.), Academic, New York,
and Products Using Oxygen Consumption Calori- 1978, Vol. 14, pp. 1-105.
meter, American Society for Testing and Materials, 26. Georgiadis, J. G., and Catton, I., J. Heat Transf.
Philadelphia, PA, 1984. ASME Trans. 110:635-641 (1988).
16. Babrauskas, V., Fire Safety J. 17:13-26 (1991). 27. Smoot, D. L., Fossil Fuel Combustion (W. Bartok and
17. Ohlemiller, T. J., Combust. Flame 81:341-353 (1990). A. F. Sarofim, Eds.), Wiley, New York, 1991, p. 653.
18. Ohlemiller, T. J., Combust. Flame 81:354-365 (1990). 28. Patankar, S. V., Numerical Heat Transfer and Fluid
19. Kansa, E. J., Perlee, H. E., and Chaiken, R. F., Flow, McGraw-Hill, New York, 1980.
Combust. Flame 29:311-324 (1977). 29. Isaacs, J. L., J. Fire Flamrnab. 1:36-42 (1970).
20. DiBlasi, C., Crescitelli, S., Russo, G., and Cinque, G., 30. SFPE Handbook of Fire Protection Engineering, P. J.
Combust. Flame 83:333-344 (1991). DiNenno, Editor-in-Chief, National Fire Protection
21. Fenimore, C. P., and Martin, F. J., Combust. Flame Association, Quincy, MA, 1988.
10:135-139 (1966). 31. lncropera, F. P., and DeWitt, D. P., Fundamentals o]
22. ASTM D-2863-87, Fire Test Standards, 3rd ed., Heat and Mass Transfer, 3rd ed., Wiley, New York
American Society for Testing Materials, Philadelphia, 1990.
PA, 1990. 32. Kanury, A. M., and Holve, D. J., J. Heat Transl.
23. Moallemi, M. K,, Zhang, H., and Kumar, S. (to be A S M E Trans. 104:338-343 (1982).
submitted).
24. Gary, W. G., and O'Neill, K., Water Resour. Res.
12:148-154 (1976). Received 16 June 1992; revised 7 April 1993