COMPUTATIONAL COMBUSTION 2007, ECCOMAS Thematic Conference K. Bashirnezhad, M. Moghiman and L. Mirboroun 18-20 July 2007, Delft, The Netherlands EFFECT OF SWIRL NUMBER ON SOOT FORMATION IN TURBULENT GAS FIRED DIFFUSION FLAMES Kazem Bashirnezhad*, Mohammad Moghiman† and Leili Mirboroun‡ *Islamic Azad University – Mashhad Branch, Faculty of ENG, Mashhad, Iran e-mial: bashirnezhad@yahoo.com † Ferdowsi University, Faculty of ENG, Mashhad, Iran e-mial: mmoghiman@yahoo.com ‡ e-mial: mirboroon@gmial.com Key words: Soot, Swirling Flow, Methane Flame, Turbulent Flame Abstract. The present study is concerned with measuring and simulating soot and flame structure of non-premixed gas fired swirl stabilized combustor. Filter paper technique is used to measure soot volume fraction inside the combustor. The numerical simulation is based on the solution of the fully-coupled conservation equations for swirling turbulent flow, chemical species kinetic modeling, fuel combustion and soot formation and oxidation. The soot particle number density and the mass density based on the acetylene concentrations are used to model the soot emission in confined swirling turbulent diffusion flame. The comparison between predictions and measurements over a range of different swirl numbers shows good agreement. The results reveal the significant influence of swirl intensity on combustion characteristics and soot concentration in diffusion flames. The results show that an increase in swirl number enhances the mixing rate, peak temperature, and soot volume fraction inside the flame zone. The locations of the maximum temperature and soot concentration shift closer to the combustor inlet with increase in swirl number. Nomenclature ag absorption coefficient of gas c1 scaling factor for the soot inception model (s-1) c2 c3 scaling factor for the soot growth (kg.m.kmol-1.s-1) c4 scaling factor for the OH oxidation rate (kg.m.kmol-1.k0.5.s-1) Db burner throat diameter (m) G axial flux of angular momentum (kg.m2.s-2) scaling factor for the O2 oxidation rate (kg.m.kmol-1.k0.5.s-1) Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun Gx h m M N NA r R Rj SN Sh T u v w W x axial flux of linear momentum (kg.m.s-2) enthalpy (j.kg-1) mass fraction soot mass density (kg.m-3) soot particle number density(m-3) Avogadro's number radial direction (m) universal gas constant (j.kg-1.k-1) reaction rate mass of the j th species swirl number energy conservation equation source term mean temperature (k) axial velocity component (m.s-1) radial velocity component (m.s-1) swirl velocity (m.s-1) molecular weight (kg.kmol-1) axial direction (m) Greek letters mj 1 molecular viscosity of gas phase (kg.m-1.s-1) gas phase density (kg.m-3) collision efficiency of soot particles laminar exchange coefficient INTRODUCTION The non-premixed flames often contain locally fuel-rich regions where the decomposition products produce larger hydrocarbons instead of being oxidized to carbon dioxide and water. This process, termed hydrocarbon growth, is normally undesirable since it ultimately produces soot particles and carcinogenic polycyclic aromatic hydrocarbons (PAH) according to Mecnally et al.1 and Roesler et al.2. The process of soot production from hydrocarbon fuels consists of fuel pyrolysis, formation of polycyclic aromatic hydrocarbons, particle inception, coagulation, surface growth, and oxidation3-5. The soot formation is strongly dependent on the PAH concentration and temperature domain5. Early mechanistic models suggested that the first aromatic ring was formed by the addition of acetylene to C4 radicals and that the key growth process toward increasingly larger PAH occurred by continuous addition of C2H22. The formation/combustion of soot in laminar and simple turbulent jet diffusion flames has been studied by many researchers6-10. Brooks and Moss9 presented results of numerical modeling of piloted axisymmetric turbulent methane-air simple jet (without swirl) flames using an extended flamelet approach. Kronenburg et al.10 investigated the modeling of soot formation and oxidation in the same flames by the conditional moment closure (CMC) method. Generally the two models have showed good agreement with the experimental measurements. Swirling flows are used in many technical applications particularly in furnaces Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun and gas turbines to improve flame stabilization, ignition stability, mixing enhancement, pollutant reduction and blow-off characteristics11,12. Although the effect of many parameters on soot formation has been investigated by many investigators, but the influence of swirl intensity on soot formation has not been studied. The aim of this paper is to study the effect of swirl intensity on soot formation and oxidation in swirling turbulent diffusion flames. The investigation is conducted with both numerical simulation and experimental measurements. 2 EXPERIMENTAL SET-UP A horizontal laboratory combustor with a circular cross-section designed and constructed to confine the flame and prevent gas composition fluctuations resulting from the ambient air. The combustor is 360 mm in diameter and 1000 mm in length, that ensures simulation of the essential physics of combustor. An air swirler is installed at the front of the burner and the swirl level is easily controlled by varying the swirler. A schematic diagram of the experimental set-up is illustrated in figure 1. THERMOMETER SOOT METER Air Mhetane Air Figure 1: Schematic of the experimental set-up Some circular slots are cut into the upper side of the combustor body so that the soot meter and thermocouple probes can be inserted into the center of the cylindrical combustor. Soot concentration is measured using the filter paper technique13. This technique is an optical method whose results are dependent on soot reflective index. Even extremely low soot concentration in the exhaust gas can be measured because the sample volume can be varied. The temperature inside the combustor is measured using the ceramic-sheathed type Sthermocouples (radiation-shielded) with a thermal resistance up to 2000 K. The described system measures temperatures within a tolerance of ±5 K. Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun Mass flow rate of the fuel and air are measured by using a Rota meter with the accuracy of 0.1lit/min. The temperature fluctuation of the inlet air and fuel is kept within the specified margins of 3 K. The repeatability of the data is regularly checked during each experimental session. On average, all of the data can be reproduced to within 10% of the mean value. The combustor flow-gas is continuously monitored during the measurement program to sense any change in the combustor operating conditions. In addition, although every effort is made to eliminate sources of gas leakage in the combustor construction, the combustor pressure is maintained close to atmospheric value. 3 MATHEMATICAL MODELING In this study, the following basic assumptions are made to produce a mathematical model for various processes inside the combustor: One considers that an axisymmetric two-dimensional computational fluid dynamics analysis of a turbulent diffusion flame is able to predict gas velocity, temperature and 14 species concentration profiles with sufficient accuracy. The soot particle phase is considered to be dilute and is considered not to effect the gas flow field. The soot formation model is based of acetylene concentration and soot combustion model is based OH and O2 concentration. Buoyancy forces are neglected. Methane is considered as the fuel. The mathematical model is based on a typical Eulerian formulation. The time averaged equations are as follows: 3.1 Continuity and momentum equations u 1 (rv) 0 x r r (1) ____ ____ 1 p 1 (ruu) (ruv) 2u (r u ' v') ( u ' u ') r x r x r r x (2) ____ ____ 1 p v 1 1 ______ 2 2 ' ' ' ' ( r uv ) ( r vv ) w ( v ) ( r v v ) ( u v ) w' w' r x r r r r x r r2 (3) ____ _____ 1 w 1 1 ______ 2 ( r uw ) ( r vw ) vw ( w ) ( r v ' w ' ) ( u ' w ' ) v' w' r x r r r x r r2 (4) The turbulent stresses are calculated from an algebraic stress model14. Furthermore, a conventional wall-function approach is used in the near-wall region to bridge the viscous sublayer. The swirl number (SN) which is a non-dimensional parameter, characterizes the Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun degree of swirl in a swirl flow and is defined as the ratio of the axial flux of angular momentum to the axial flux of axial momentum11,14. At the air inlet of the burner chamber SN is obtained from: SN 2G Gx Db Db / 2 D 2 0 b uwr 2 dr Db / 2 0 u 2 rdr (5) 3.2 Energy equation ____ _____ 1 1 2 ( r uh ) ( r vh ) h ( r v ' h ' ) ( u ' h ' ) S h h r x x r r x (6) The energy addition due to combustion ( S h ) is determined by using a reduced mechanism for methane combustion based on results from Chen15. The global steps of this 10-step mechanism and 14 species include CH4, CH3, O, O2, H, H2, CO, CO2, OH, C2H2, C2H4, C2H6, H2O, and CH2O are summarized below: O2 + 2 CH3 + C2H4 = H + 2 CH4 + CO2 + 1/2 C2H2 O2 + 2 CH3 = H2 + CH4 + CO2 O2 + 3 CH3 = H + 2 CH4 + CO2 O2 + CH3 + CO = H + CO2 + CH2O O2 + CO + C2H6 = CH4 + CO2 + CH2O O2 + 2CO = 2 CO2 H + O2+ CO = OH + CO2 H2 + O2+ CO = H + OH + CO2 O2 + H2O + CO = 2OH + CO2 O2 + 1/2 C2H2 = H + CO2 (R1) (R2) (R3) (R4) (R5) (R6) (R7) (R8) (R9) (R10) In this study, the reaction rates that appear as source terms in species transport equations (equation 6) are controlled by finite rate method. The conservation equation for jth species takes the following general form: ______ ______ 1 1 (rum j ) (rvm j ) mj 2 m j (r v' m j ') ( u' m j ') R j r x r r r x (7) In this study, species conservation equation is solved for all of the 14 species. 3.3 Soot modeling The emission of soot from a flame is determined by a competition between soot formation and oxidation that must be considered when a soot modeling study is carrying out. In this Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun study, a recent soot model developed by Brookes et al.9 is used. The model describes the soot formation in terms of the soot particle number density (N) and the soot particle mass density (M) and takes into account the inception (nucleation), coagulation, growth, and oxidation processes for the rates of these two parameters as: DN dN dN Dt dt Inception dt Coagulation (9) DM dM dM dM Dt dt Inception dt Growth dt Oxidation (10) The model proposed by Leung et al.16, is used to predict soot inception. In this model, it is assumed that acetylene is primarily responsible for the nucleation and the growth of soot particles. The inception step is treated simply as a one-step process: C 2 H 2 2C SOOT H 2 (11) The rate of inception is assumed to be first order in acetylene concentration so that the rate is calculated as: mC2 H 2 dN c1 N A WC H dt Inception 2 2 21100/ T e (12) M dN dM P dt Inception N A dt Inception (13) where Mp, the mass of a soot nucleus, has a value of 144 kg.kmol-1 based on the assumption that the soot size corresponds to 12 carbon atoms and c1=54 s-1 determined by Brookes and Moss9. Assuming the particles are mono-dispersed in size and spherical, the coagulation rate and reaction surface or growth rate are given by: 1/ 2 24 R dN dt coagulation Soot N A mC H dM c2 2 2 WC H dt growth 2 2 1/ 6 6 Soot (14) T 1 / 2 M 1 / 6 N 11/ 6 21100/ T 6M e N 1 / 3 Soot 2/3 (15) where soot 2000kgm 3 and c2 =9000.6 kg · m · kmol-1 · s-1 according to Brookes et al.9. The oxidation model takes into account combustion of soot by O 2 and OH radicals. In this model, the rate of soot oxidation is given by: m dM c4 OH dt W Oxidation OH 6M T (N )1 / 3 Soot 2/3 c3 mO2 WO2 exp( 19778 1 / 3 6M ) T N T Soot 2/3 (16) where is set to be 0.13 and c3= 8903.51kg·m·kmol-1·K1/2 c4 =105.81 kg · m · kmol-1· Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun K-1/2 · s-1, which are obtained by converting the rate of soot mass consumption9. 4 METHOD OF SOLUTION The conservation equations are solved using a control-volume based computational procedure17. The flow field pressure linked equations are solved by the SIMPLE algorithm and the set of algebraic equations are solved sequentially with the line-by-line method which is a combination of Gauss-Seidel method and tridiagonal-matrix algorithm. The convergence criterion is determined by the requirement that the maximum value of the normalized residuals of any equation must be less than 1 10-5. Under-relaxation factor is chosen as 0.25 for all dependent variables. A numerical mesh of 350 230 grid nodes is used after several experiments, which shows that further refinement in either direction does not change the result (maximum difference in velocity and other scalar functions in the carrier phase) by more than 2%. The grid spacing in axial and radial directions are changed smoothly to minimize the deterioration of the formal accuracy of the discretization scheme due to variable grid spacing and in such a way higher concentration of nodes occur near the inlet and the walls. 5 RESULTS AND DISCUSSION Figure 2 shows the simulated contours of temperature inside the combustor for different swirl numbers. The results show that an increase in swirl number increases the combustor peak temperature. This occurs because an increased swirl number increases combustion efficiency due to enhancement of mixing rates between the fuel and oxidant. The location to give the maximum temperature shifts to forward with decrease in swirl number. This shift is corresponding to the fact that the combustion zone of the diffusion flame is enlarged with decrease in swirl number. This observation is in according with the results of Yapici et al.18. Comparison between the computed and measured temperatures is shown in figure 3. It can be seen that the predicted temperature profiles have very good agreement with measurement results especially with respect to the maximum temperature value and its location. The results show that the 10 steps reduced mechanism used in this paper as combustion model is able to predict methane-air diffusion flame characterizations with sufficient accuracy15. Figure 4 shows the distribution of soot volume fraction inside the furnace for different air inlet swirl numbers. It can be seen that swirl intensity affects the peak soot concentration and its location. The figure shows that an increase in swirl number although increases the peak soot volume fraction, but decreases the soot emission from the furnace. This occurs because an increase in swirl number enhances the rates of mixing and combustion. The soot combustion rate is affected by O2 and OH concentration. Measured and computed soot volume fractions are compared in figure 5, where the centerline soot volume fraction profiles are plotted for different swirl numbers. It is observed that the agreements between measured and predicted results are satisfactory. There is a slight discrepancy between the predictions and measurements for condition SN=0.0. Measurements show higher soot volume fraction in the vicinity of the point of the issue. Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun Considering the soot model equations specifies two main parameters that affect on soot formation, i.e. acetylene concentration and soot particle density which need to be analyzed more. Figure 6 show centerline acetylene concentrations for three swirl numbers 0.2, 0.4, and 0.6. Acetylene concentration plays effective role in soot nucleation and surface growth10,16. It can be seen that as expected, the location of peak C2H2 mass fraction is in the vicinity of the combustor inlet zone where the fuel concentration and temperature levels are high (see figures 2 and 3). The figure shows that swirl intensity can affect on peak value of acetylene concentration and its location in combustor. It is seen that an enhancement in swirl number increases C2H2 peak concentration. Figure 7 displays the centerline distributions of soot particles density for three swirl numbers. It can be seen that soot particles density along the combustor centerline increases to maximum and then decreases. As expected the trend of variation of soot particles density is similar to the variation of temperature profiles (see figure 3). The distribution of the soot number density moves towards to combustor inlet with increase in swirl number. Figure 8 presents the influence of swirl number on soot volume fractions along the combustor centerline. It can be seen that swirl intensity affects on the peak soot concentration and its location. Clearly the distribution of soot volume fraction along the combustor centerline strongly depends on the distribution of temperature and acetylene mass fraction (see figures 2 and 6). 6 CONCLUSION – Burning behaviors of non premixed methane-air flame are experimentally and computationally studied for different swirl numbers. – The soot particle number density and the mass density based on the acetylene concentrations are used to model the soot emission in confined swirling turbulent diffusion flame. – The results show the significant influence of swirl number on soot distribution inside the combustor. – The results also show that an increase in swirl number enhances the mixing rate, peak temperature, and peak soot volume fraction near the burner. – The results reveal that an increase in swirl number although increases peak soot concentration, but decreases the soot emission from the furnace. This occurs because an increase in swirl number enhances the rates of mixing and soot combustion. – The comparison of numerical predicted results with measurements show good agreement. Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun a: SN=0.0 b: SN=0.2 1400 c: SN=0.4 d: SN=0.6 1400 1400 1500 1500 1500 1500 1529 1600 1400 1641 1200 1600 1600 1667 1724 800 1200 1300 1400 Figure 2: Effect of swirl number on predicted temperature contours 1600 1400 1200 1000 800 SN=0.0 600 Temperature (K) Temperature (K) 1600 400 1400 1200 1000 800 600 400 0.25 0.5 0.75 1 Axial distance from burner (m) 1600 1800 1400 1600 1200 1000 SN=0.4 600 400 Temperature (K) Temperature (K) 0.25 0.5 0.75 1 Axial distance from burner (m) 800 SN=0.2 1400 1200 1000 800 600 SN=0.6 400 0.25 0.5 0.75 1 Axial distance from burner (m) 0.25 0.5 0.75 1 Axial distance from burner (m) Figure 3: Comparison between the computed (lines) and measured (symbols) centerline temperatures for different swirl numbers Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun SN=0.0 SN=0.4 SN=0.2 7.19E-07 5.40E-07 4.79E-07 SN=0.6 3.46E-07 4.10E-07 6.48E-07 9.37E-07 1.07E-06 7.74E-07 9.25E-07 6.64E-07 1.22E-06 1.08E-06 1.29E-06 1.36E-06 1.15E-06 5.05E-08 1.32E-06 1.39E-06 2.80E-10 3.51 E-07 3.36E-07 2.45E-13 4.10E-07 6.67E-09 5.52E-09 2.66E-29 1.85E-11 1.16E-13 6.97E-08 2.31E-09 Figure 4: Soot volume fraction distributions inside the furnace 1.6E-06 Soot volume fraction Soot volume fraction 1.6E-06 1.2E-06 8E-07 4E-07 0 0.0 SN=0.0 0.2 0.4 0.6 0.8 Axial distance (m) Soot volume fraction Soot volume fraction 4E-07 SN=0.2 0.2 0.4 0.6 0.8 Axial distance (m) 1.0 1.6E-06 1.2E-06 8E-07 0 0.0 8E-07 0 0.0 1.0 1.6E-06 4E-07 1.2E-06 SN=0.4 0.2 0.4 0.6 0.8 Axial distance (m) 1.0 1.2E-06 8E-07 4E-07 0 0.0 SN=0.6 0.2 0.4 0.6 0.8 Axial distance (m) 1.0 Figure 5: Comparison between the computed (lines) and measured (symbols) centerline soot volume fractions for different swirl numbers C2H2 Mass fraction Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun 0.004 0.003 SN=0.2 SN=0.6 0.002 SN=0.4 0.001 0.2 0.4 0.6 0.8 1.0 Axial distance from burner (m) Figure 6: Effect of swirl number on predicted centerline acetylene concentrations 5E+15 SN=0.6 SN =0 .4 4E+15 .2 3E+15 =0 2E+15 SN Soot particles density 0.0 1E+15 00.0 0.2 0.4 0.6 0.8 Axial distance from burner (m) 1.0 Figure 7: Effect of swirl number on predicted centerline soot particles density .2 =0 0 .6 4 SN 8E-07 =0 . 1E-06 SN 1.2E-06 S N= Soot volume fraction 1.4E-06 6E-07 4E-07 2E-07 0 0.0 0.2 0.4 0.6 0.8 1.0 Axial distance from burner (m) Figure 8: Effect of swirl number on predicted centerline soot volume fractions Kazem Bashirnezhad, Mohammad Moghiman and Leili Mirboroun REFERENCES [1] [2] [3] [4] [5] [6] [7] [8] [9] [10] [11] [12] [13] [14] [15] C. 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