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International Journal of Theoretical and Applied Mechanics. ISSN 973-685 Volume 1, Number 4 (17) pp. 681-697 Research India Publications http://www.ripublication.com Flame Characteristics of Commercial Fuels With Respect to Single Droplet Combustion - For Spray Applications Shah Shahood Alam and Arees Qamareen Pollution and Combustion Engineering Lab. Department of Mechanical Engineering, Aligarh Muslim University, Aligarh-, U.P. India. Abstract In the present work, a spherically symmetric, unsteady liquid droplet combustion model has been evolved and tested for variation in ambient pressure and temperature using important commercial fuels like diesel fuel DF, automobile gasoline and jet propulsion fuel JP5. Transient diffusive equations of energy and species in the gas phase surrounding the droplet were solved numerically to provide for the temperature and species concentration profiles (fuel vapour and oxidiser). From these profiles, important flame characteristics like instantaneous flame to droplet diameter ratio ( FD / ), flame standoff distance ( FD - )/, dimensionless flame diameter ( FD / ) and dimensionless diameter squared ( D/ D ) and were then calculated as a function of time and their variation was plotted against time. These plots were drawn for three cases of (i) steady state combustion, (ii) droplet heating and (iii) droplet heating with convection. Apart from that, some important thermodynamic properties were also investigated with respect to ambient temperature and pressure. Results of the present study can be useful in modelling of spray combustion. Keywords: Unsteady liquid droplet combustion model, numerical technique, commercial fuels, ambient temperature and pressure effects, droplet burning parameters, spray analysis. *Corresponding author. E-mail: sshahood4@yahoo.co.in.

68 Shah Shahood Alam and Arees Qamareen 1. INTRODUCTION AND LITERATURE REVIEW Droplet combustion has relevance to many practical combustion devices, including diesel, rocket and gas turbine engines, as well as oil fired boilers, furnaces etc. Although in all these devices, spray combustion rather than individual droplet burning is the dominant feature, however understanding isolated droplet burning is an essential pre-requisite which serves as the fundamental step for understanding the complex process of spray combustion which is currently responsible for a large proportion of the total energy requirements of the world (approximately 5%). For both droplet evaporation and burning, closed form analytic solutions to the simplified governing conservation equations are possible. These solutions allow us to explore the influence of droplet size and ambient conditions on the droplet gasification rates (mass burning rates), and droplet life times that are important in the design and operation of practical devices. In addition to developing droplet combustion models, we can extend these simple models for arrays and sprays which can be incorporated in one dimensional analysis of a combustor [1]. 1.1 Experimental Methodology Experimental study of droplet combustion has employed following methods: (i) (ii) A single droplet suspended at the end of a thin quartz fiber. A freely falling single droplet or droplet stream. (iii) A porous sphere with liquid fuel being fed to its interior at such a rate that the surface is just wetted to support combustion. This is the steady state droplet combustion which yields the d -law or in other words, the quasisteady combustion. Actual experimental results show the following inadequacies of the d -law. (a) During a short, initial period the droplet size hardly changes. This is caused by droplet heating. (b) The instant flame radius is not a constant but varies with time. This is caused by fuel vapor accumulation. (c) The experimental flame standoff ratio r / r also varies with time unlike the quasisteady theory where it assumes a large constant value. (d) This ratio is also much smaller than the theoretical value. This is caused by variable property effect. The following conclusions can be made regarding droplet heating for a single component fuel in a quiescent environment, whose pressure is also sufficiently below that of the fuel's critical pressure []. f l

Flame Characteristics of Commercial Fuels With Respect to Single Droplet 683 (i) (ii) Droplet heating proceeds fairly rapidly during the droplet life time. The period of heating subsequent to ignition is expected to be not too sensitive to fuel volatility. (iii) Droplet heating only slightly prolongs the total burning time of the droplet. (iv) The droplet temperature distribution may remain non uniform and temporally varying throughout the lifetime. 1. Spherically Symmetric Droplet Combustion Model The combustion of an isolated, spherically symmetric liquid fuel droplet in an oxidizing medium is shown schematically in Figure 1. Following assumptions are invoked for the steady state, spherically symmetric, droplet combustion model (Figure 1): 1. The spherical burning droplet, surrounded by a spherically symmetric flame exists in a quiescent infinite medium and the effects of buoyancy and convection are absent.. The fuel is single component liquid with zero solubility for gases. The droplet is at its boiling point temperature, (i.e. steady state evaporation). Also, phase equilibrium prevails at the liquid-vapour interface. 3. The pressure is uniform and constant. 4. The gas phase consists of only two species : fuel vapour and oxidizer. The gas

684 Shah Shahood Alam and Arees Qamareen phase region is divided into two zones. The inner zone between the droplet and the flame consist only fuel vapour, while the outer zone consists of oxidizer. 5. Fuel and oxidizer react in stoichiometric proportions at the flame. chemical kinetics is assumed to be infinitely fast, resulting in the flame being represented as an infinitesimally thin sheet (Burke-schumann flame). 6. The gas phase Lewis Number (Leg) is unity (i.e. quasisteady gas phase). This means that gas phase transport processes are occurring at a very fast rate as compared to liquid phase processes. 7. Radiation heat transfer is negligible. 8. The gas phase thermal conductivity kg, specific heat Cpg, and the product of the density and mass diffusivity gdg, are all constants. In this spherically symmetric configuration, fuel vaporizes at the droplet surface and diffuses outward while oxidizer diffuses inward from the ambient environment. The fuel and oxidizer react stoichiometrically, resulting in a zone of intense reaction (a non premixed flame). Heat is transported via conduction and radiation outward from the flame to ambient atmosphere and inward back to the droplet surface. The heat deposited at the droplet surface is fully utilized by the evaporation process at the vapour/liquid interface. This implies that droplet surface decreases linearly with time or in other words the d -law is followed. 1.3 Fuel Vapor Accumulation The existence of the fuel vapour accumulation process implies that overall mass conservation for the fuel vapour should read, vaporisation rate at droplet surface = consumption rate at flame + accumulation rate in inner region. For above formula, the last term is absent in the d law. An important practical implication of fuel vapour accumulation is that since the fuel gasification rate is not equal to the fuel consumption rate, adoption of the d -lawin spray modeling may result in grossly erroneous estimates of the bulk chemical heat release rate. Finally, it may be noted that because of the inherently transient nature of fuel accumulation, porous sphere experiments cannot simulate droplet combustion, especially with regard to the flame characteristics. 1.4 Extension to Convective Environment A simplified approach involves the extension of spherically symmetric model to forced convective situation using empirical correlations which are a function of gas phase Nusselt, Reynolds and Prandtl numbers [1].

Flame Characteristics of Commercial Fuels With Respect to Single Droplet 685 One commonly used emperical result is that of Ranz and Marshall that corrects the spherically symmetric vaporisation rate for forced convective environment [3].. PROBLEM FORMULATION.1 Spray Combustion Spray combustion is a complex phenomenon that requires a thorough prior knowledge of the laws governing droplet evaporation/combustion. Various models accounting for droplet vaporization, drag, breakup, collision etc have to be analysed simultaneously for studying spray behavior. One of the most essential aspects of spray analysis is the choice of an appropriate droplet vaporization/combustion model which is going to predict the spray characteristics like mass burning rate, residence time and emission behaviour. While droplet breakup/collision models etc are primarily governed by fluid dynamics, droplet combustion model is evolved from thermodynamics considerations. Inclusion of oversimplified models may give approximate results whereas complex models are generally overlooked to avoid costly computations. Hence, droplet combustion model has to be simple, but realistic [3]. The transportation sector accounts for about 97% of energy consumption which is in the form of liquid spray combustion prevalent in internal combustion engines, where liquid sprays are made up of droplets ranging in size from 3-1 m. In combustion devices such as diesel engines and gas turbines, the existing air pressure and temperature before combustion can be as high as 1 bar and 8 K. Further, these engines operate with multicomponent fuels burning in high temperature/pressure environment, undergoing dissociation in presence of air in forced convective conditions. Therefore, from combustion engineer point of view, correct estimation of flame temperature which is dependent on so many factors is of high priority since it is an important parameter in engine combustor design.. Methodology for Determining Adiabatic Flame Temperature and Thermodynamic Properties. In the present work, Gulder s model [4] has been incorporated in our code. This code calculates AFT of pure and MC fuels as a function of ambient pressure, temperature and equivalence ratio. However, certain thermodynamic properties have to be pre-calculated which are used as input variables to the code. These include boiling point, heat of vaporization and liquid density. For diesel fuel, DF, the boiling point was evaluated as a function of pressure using

686 Shah Shahood Alam and Arees Qamareen Redlich-Kwong EOS. Enthalpy of vaporization was determined from Watson Correlation, while liquid density at high pressure was obtained using Hankinson-Brobst-Thomson technique through a computer program developed in the present work. The same techniques were used for JP5 (gas turbine fuel) and motor gasoline [5]. For analyzing the phenomenon of high pressure droplet combustion for the three cases (steady state/with droplet heating/droplet heating with convection), the relevant thermal properties must be estimated first. In the present work, these properties were obtained through computer programmes. Viscosities of pure gases and their mixtures at high pressures were calculated using the method of Bird et. al [6] and Wilke methods [5] respectively. Pure gas and gaseous mixture thermal conductivity at high pressure were determined through Steil and Thodos correlation [5]. Gaseous specific heats at low pressures were evaluated using polynomial form whereas at high pressures, both pure and mixture specific heats were obtained by Lee- Kesler technique [5]. Liquid specific heats were estimated using the Lee-Kesler method, although Rowlinson-Bondi method can also be employed. Real gas densities were calculated using Kay s rule [5]..3 Mathematical Formulation and Droplet Combustion Characteristics As mentioned before, droplet combustion experiments have shown that liquid droplet burning is a transient phenomenon. This is verified by the fact that the flame diameter first increases and then decreases and flame to droplet diameter ratio increases throughout the droplet burning unlike the simplified analyses where this ratio assumes a large constant value. Keeping this in mind, an unsteady, spherically symmetric, single component, diffusion controlled gas phase droplet combustion model was developed by solving the transient diffusive equations of species and energy. With the assumptions discussed earlier, the following equations for energy and species were derived for the gas phase: T T g T T g v r t r r r r Y Y D g Y Y Dg v r t r r r r (.1) (.) T and Y are temperature and species mass fraction, g and Dg are gas phase thermal and mass diffusivities, r and t are respectively the radial coordinate and time. Neglecting radial velocity of fuel vapour v r for the present model, equations (.1) and

Flame Characteristics of Commercial Fuels With Respect to Single Droplet 687 (.) reduce to a set of linear, second order partial differential equations given as: Y Y D g Y Dg t r r r (.3) T T g T g t r r r (.4) The solution of these equations provide the species concentration profiles (fuel vapour and oxidiser) and temperature profile for the inflame and post flame zones. The boundary and initial conditions based on this combustion model are as follows: at r r ; T T, Y, Y f f o, f F, f at r r ; T T, Y o,.3, at t ; r r, T T, Y 1. lo b F, S 1/ is the moving boundary condition coming out where r r 1 t / t for t t, from the l lo d d d -law (since droplet is at its boiling point temperature). Here, T f, T b and T are respectively the flame, boiling point and ambient temperatures. Y FS, and F, f Yo, and o, f Y are fuel mass fractions respectively at the droplet surface and flame. Y are oxidiser concentrations in the ambience and at the flame respectively, t is the instantaneous time, t d is the combustion lifetime of the droplet, r lo is the original or initial droplet radius and r l is the instantaneous droplet radius at time t. The location where the maximum temperature T T or the corresponding concentrations YF, f and Yo, f occur, was taken as the flame radius r f. Instantaneous time t was obtained from the computer results whereas the combustion lifetime t d was determined from the relationship coming out from the d -law. Other parameters like flame standoff ratio ( FD / ), flame standoff distance ( FD - )/, dimensionless flame diameter ( FD / ) etc, were then calculated as a function of time. f

688 Shah Shahood Alam and Arees Qamareen.4 Solution Technique Equations (.3) and (.4) were solved numerically using finite difference technique. The approach is simple, fairly accurate and numerically efficient. Here the mesh size in radial direction was chosen as h and in time direction as k. Using finite difference approximations, equations (.3) and (.4) were descritised employing three point central difference expressions for second and first space derivatives, and the time derivative was approximated by a forward difference approximation resulting in a two level, explicit scheme (equation.5) which was implemented on a computer. 1 1 1 T p T T p T (.5) n1 n n n m 1 m m1 1 m 1 m m1 Here, Nh = r r, m ( ) /, / 1 mesh ratio k h pm h rm, r m r lo mh l,1,... N o The solution scheme is stable as long as the stability condition 1 1/ is satisfied. 3. RESULTS AND DISCUSSION The results of the present work are shown for the three commercial fuels, namely: diesel fuel (DF), jet propulsion fuel (JP5) and automobile gasoline (AG). These results are presented in the form of important combustion parameters like dimensionless flame diameter F/ D, flame standoff distance ( F D) /, dimensionless diameter squared ( D/ D ) and flame standoff ratio F/ D varying with time. A plot of dimensionless flame diameter F/ D variation with dimensionless time t/ t d is shown in Figure for a 1 m, spherically symmetric fuel droplet burning in standard atmosphere. It is observed that the flame diameter first increases, reaches a maxima and decreases to a minimum value. However, F/ D is maximum for DF, followed by JP5 and then AG. This trend is obtained because of the transient nature of droplet burning, that is the flame diameter first increases and then decreases. Further, the maxima of F/ D depends upon the fuel s boiling point which is highest for DF followed by JP5 and AG. The same trend is seen for the plot of flame standoff distance ( F D) / versus dimensionless time t/ t d, (Figure 3). Since here again the flame diameter is increasing first, reaching a maxima and then gradually decreasing. For Figure 4 it is observed that when the square of dimensionless droplet diameter ( D/ D ) is drawn against instantaneous time t for steady state droplet burning, the maximum time for complete burning of the droplet is taken by DF followed by AG and JP5.

Flame Characteristics of Commercial Fuels With Respect to Single Droplet 689 This is because the value of Kb is highest for DF followed by AG and JP5. This in turn is dependent on the cumulative influence of properties involved in K b. Further, it is also noted that the d -law is being followed. The variation of flame standoff ratio F/ D against dimensionless time t/ t d for different fuels (Figure 5) shows that the F/ Dvalue increases throughout with dimensionless time for each fuel. This diagram depicts the true or actual nature of droplet combustion as suggested by experiments where F/ D increases throughout the droplet burning history. Here the instantaneous droplet diameter D decreases throughout whereas the flame diameter F first increases and then decreases so that the F/ D ratio increases throughout. This result shows that the transient droplet combustion model developed in the present work is in conformity with the observed droplet burning phenomenon. This behaviour is also shown in Figure 6, where F/ Dratio is plotted against instantaneous time t. It is observed that the results of the present model and experimental work [7] are very close to each other, whereas those of quasi steady theory are in error, which suggests that any realistic droplet combustion model should include the transient phenomenon. Figures 7 to 1 show the variation of the above parameters for the case of droplet heating. It is observed that there is no effect of droplet heating on flame dimensions (Figures 7, 8 and 1). However a plot of ( D/ D ) versus time (Figure 9) indicates that the maximum burning time was taken by DF, followed by JP5 and AG. Although this trend matches the behaviour shown in Figure 4, the respective values for burning time for each fuel is increased. This is because the droplet now needs more time to get consumed due to droplet heating. For the case of droplet heating with convection, the behaviour of various burning parameters (Figure 11, 1 and 14) is the same as before. However, Figure 13 shows that the time taken by DF is again maximum followed by JP5 and AG. Although, the respective time taken by each fuel is smaller than the droplet heating case (Figure 9), due to convection effects which increase the droplet evaporation rate. The effect of ambient temperature T on droplet combustion is depicted in Figures 15-16. It is observed that it has no effect on the flame dimensions but has a significant effect on the droplet lifetime (Figure 16), which gets reduced as the ambient temperature is increased. This behaviour is because as T is increased, flame temperature is also increased and

69 Shah Shahood Alam and Arees Qamareen the amount of heat conducted from the flame towards the droplet surface is increased which results in faster evaporation and enhanced burning rate which subsequently leads to lower lifetime. Figures 17- show the effect of ambient pressure P on burning characteristics. It is seen that as P is increased, so is the boiling point of the fuel. The cumulative effect of properties results in an increase in the flame diameter. Hence dimensionless flame diameter F/ D, flame standoff distance ( F D) / and flame standoff ratio F/ D increase with an increase in the ambient P, whereas droplet lifetime decreases with increase in P (Figure 19). A plot of F/ Dversus reduced ambient pressure P r (Figure 1) shows that at dimensionless time t/ t d =, F/ Dvalues increase as the reduced pressure Pr is increased. The same trend also exists in Figure for t/ t d =, when P is increased from 1 bar to 1.6 bar for DF. It can be added that the same trend in F/ D variation is also shown in the numerical work of Kotake and Okazaki [8]. The important burning variables like transfer number (.6) burning constant d 4 / SS lo bss B [ h / cp T T ]/ L, TSS c air fv b k 8k ln 1 B / cp, (.7) droplet lifetime bss air fv TSS l air fv t r k, (.8) and droplet mass burning rate m r k /, (.9) f l l b ss for steady state combustion are determined using the above equations. h c is the heat of combustion of fuel (kj/kg), is the ( A/ F ) stoich on mass basis, L is the latent heat of vaporization (kj/kg), l is the liquid density, rl and r lo are the instantaneous and original droplet radii respectively. Further, kair fv and cpair fv are the gas phase thermal conductivity and specific heat of (air+ fuel vapour mixture). The transfer number is modified for the cases of droplet heating and droplet heating with convection, given respectively as: B [ h / cp T T ]/ L cp ( T T ) (.1) TDH c airfv b l b l and B [ h / cp T T ] TDH CONV c air fv b.5.33 x [1.3Re g Pr g ]/[ L cpl ( Tb Tl )] Gas phase Reynolds and Prandtl numbers are given as: g / air fv air fv (.11) Re D U (.1) and Pr Cp. k. (.13) g air fv air fv air fv

Flame Characteristics of Commercial Fuels With Respect to Single Droplet 691 D is the original droplet diameter, U is the relative velocity between the droplet surface and the ambient gas, is the gas phase mixture density and air is the gas fv phase absolute viscosity. air fv Figures -6 show the variation of the properties calculated as a function of ambient pressure and temperature used in getting the above droplet combustion parameters for automobile gasoline (AG). These properties include gas phase viscosity, liquid specific heat, gas density and gas phase Reynolds and Prandtl numbers. It was observed that gas phase viscosity increases with both temperature and pressure whereas the gas phase density increases with pressure at a particular value of temperature and decreases at a fixed pressure with an increase in temperature. Liquid specific heat increases with pressure and the increase is rapid as the critical pressure is approached ( P c =6.5 bar). Re g is found to increase with increase in pressure at a fixed temperature and decreases with an increase in temperature at a particular pressure. Pr g also depicts the same behaviour. The same parameters were plotted for JP5 fuel (Figures 7-3) and the observed variations were the same as were for AG. Finally, Figures 31-35 also show the same behaviour for DF as was noted for the above two fuels. PLOTS OF RESULTS

69 Shah Shahood Alam and Arees Qamareen 5 4 F/D 3 Present Model Experiment of Okajima and Kumagai [7] Quasi-steady Model 1.5 1 1.5 t ( s ) Figure 6 Flame to droplet diameter ratio versus time for a 1336 micron n-heptane droplet burning in standard atmosphere

Flame Characteristics of Commercial Fuels With Respect to Single Droplet 693

694 Shah Shahood Alam and Arees Qamareen 4 18 F / D 1 t / t d = 6.5.5.75 1 P r Figure 1 F / D ratio versus reduced pressure for a micron n-heptane droplet

Flame Characteristics of Commercial Fuels With Respect to Single Droplet 695 CONCLUSIONS For steady state burning of a 1 m, spherically symmetric fuel droplet in standard atmosphere, it was observed that the flame diameter first increased, reached a maxima and decreased to a minimum value. Dimensionless flame

696 Shah Shahood Alam and Arees Qamareen diameter F/ D was maximum for DF, followed by JP5 and then AG. The same trend was observed from the plot of flame standoff distance ( F D) / versus dimensionless time t/ t d. When the square of dimensionless droplet diameter ( D/ D ) was drawn against instantaneous time t, the maximum time for complete burning of the droplet was taken by DF followed by AG and JP5 and. Also, it was noted that the d -law was being followed. The variation of flame standoff ratio F/ D against dimensionless time t/ t d showed that the F/ Dvalue increased throughout with dimensionless time for each fuel. The trend of different combustion parameters mentioned above showed the same behaviour for droplet heating and droplet heating with convection as were for the steady state case, except for the variation of square of dimensionless droplet diameter ( D/ D ) with time. It was observed that an increase in ambient temperature T resulted in a decrease in droplet life time. An increase in ambient pressure P led to an increase in F/ D, ( F D) / and F/ Dand a decrease in droplet lifetime. For automobile gasoline (AG), it was observed that gas phase viscosity increased with both temperature and pressure whereas the gas phase density increased with pressure at a particular value of temperature and decreased at a fixed pressure with an increase in temperature. Liquid specific heat increased with pressure. Re g was found to increase with increase in pressure at a fixed temperature and decreased with an increase in temperature at a particular pressure. Pr also depicted the same behaviour. g The same trend in these properties variation was observed for the remaining two fuels namely JP5 and DF. Scope for Future Work The present droplet combustion model is simple but realistic requiring less CPU time and can be incorporated in spray combustion codes where CPU economy is vital. This work can also be extended to evaluate emission characteristics of commercial fuels burning in combustion engines.

Flame Characteristics of Commercial Fuels With Respect to Single Droplet 697 REFERENCES [1] Turns, S. R., 1996, An Introduction to Combustion Concepts and Applications, McGraw Hill International Edition. [] Law, C.K., 198, Recent Advances in Droplet Vaporization and Combustion, Progress in Energy and Combustion Science, Vol. 8, pp. 171-1. [3] Sirignano W. A., 1999, Fluid Dynamics and Transport of Droplets and Sprays, Cambridge University Press. [4] Gülder, Ö. L., 1986, Flame Temperature Estimation of Conventional and Future Jet Fuels, Transactions of the ASME, Vol. 18, pp. 376-38. [5] Reid, R.C., Prausnitz, J. M., and Poling, B. E., 1989, The Properties of Gases and Liquids, Fourth Edition, McGraw Hill Book Company. [6] Bird, R. B., Stewart, W. E., and Lightfoot, E. N., 4, Transport Phenomena, Second Edition, John Wiley and Sons, Inc. [7] Kumagai, S., Sakai, T., and Okajima, S., 1971, Combustion of Free Droplets in a Freely Falling Chamber, Proceedings of the Thirteenth Symposium (International) on Combustion, The Combustion Institute, pp. 779-785. [8] Kotake, S. and Okazaki, T., Evaporation and Combustion of a Fuel Droplet, 1969, Int. J. Heat Mass Transfer, Vol. 1, pp. 595-69.

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