Effects of morphology and wavelength on the measurement accuracy of soot volume fraction by laser extinction

Science.gov (United States)

Wang, Ya-fei; Huang, Qun-xing; Wang, Fei; Chi, Yong; Yan, Jian-hua

2018-01-01

A novel method to evaluate the quantitative effects of soot morphology and incident wavelength on the measurement accuracy of soot volume fraction, by the laser extinction (LE) technique is proposed in this paper. The results indicate that the traditional LE technique would overestimate soot volume fraction if the effects of morphology and wavelength are not considered. Before the agglomeration of isolated soot primary particles, the overestimation of the LE technique is in the range of 2-20%, and rises with increasing primary particle diameter and with decreasing incident wavelength. When isolated primary particles are agglomerated into fractal soot aggregates, the overestimation would exceed 30%, and rise with increasing primary particle number per soot aggregate, fractal dimension and fractal prefactor and with decreasing incident wavelength to a maximum value of 55%. Finally, based on these results above, the existing formula of the LE technique gets modified, and the modification factor is 0.65-0.77.

Cluster-cluster aggregation kinetics and primary particle growth of soot nanoparticles in flame by light scattering and numerical simulations.

Science.gov (United States)

di Stasio, Stefano; Konstandopoulos, Athanasios G; Kostoglou, Margaritis

2002-03-01

The agglomeration kinetics of growing soot generated in a diffusion atmospheric flame are here studied in situ by light scattering technique to infer cluster morphology and size (fractal dimension D(f) and radius of gyration R(g)). SEM analysis is used as a standard reference to obtain primary particle size D(P) at different residence times. The number N(P) of primary particles per aggregate and the number concentration n(A) of clusters are evaluated on the basis of the measured angular patterns of the scattered light intensity. The major finding is that the kinetics of the coagulation process that yields to the formation of chain-like aggregates by soot primary particles (size 10 to 40 nm) can be described with a constant coagulation kernel beta(c,exp)=2.37x10(-9) cm3/s (coagulation constant tau(c) approximately = 0.28 ms). This result is in nice accord with the Smoluchowski coagulation equation in the free molecular regime, and, vice versa, it is in contrast with previous studies conducted by invasive (ex situ) techniques, which claimed the evidence in flames of coagulation rates much larger than the kinetic theory predictions. Thereafter, a number of numerical simulations is implemented to compare with the experimental results on primary particle growth rate and on the process of aggregate reshaping that is observed by light scattering at later residence times. The restructuring process is conjectured to occur, for not well understood reasons, as a direct consequence of the atomic rearrangement in the solid phase carbon due to the prolonged residence time within the flame. Thus, on one side, it is shown that the numerical simulations of primary size history compare well with the values of primary size from SEM experiment with a growth rate constant of primary diameter about 1 nm/s. On the other side, the evolution of aggregate morphology is found to be predictable by the numerical simulations when the onset of a first-order "thermal" restructuring mechanism is

Role of Fluid-Dynamics in Soot Formation and Microstructure in Acetylene-Air Laminar Diffusion Flames

Directory of Open Access Journals (Sweden)

Praveen Pandey

2015-03-01

Full Text Available Residence time and thermo-chemical environment are important factors in the soot-formation process in flames. Studies have revealed that flow-dynamics plays a dominant role in soot formation process. For understanding the effect of flow dynamics on soot formation and physical structure of the soot formed in different combustion environments two types of laminar diffusion flames of Acetylene and air, a normal diffusion flame (NDF and an inverse diffusion flame (IDF have been investigated. The fuel and air supply in the reaction zone in two flame types were kept constant but the interchange of relative position of fuel and air altered the burner exit Reynolds and Froude numbers of gases, fuel/air velocity ratio and flame shape. Soot samples were collected using thermophoretic sampling on transmission electron microscope (TEM grids at different flame heights and were analyzed off-line in a Transmission Electron Microscope. Soot primary particle size, soot aggregate size and soot volume fraction were measured using an image analysis software. In NDF the maximum flame temperature was about 1525 K and 1230 K for IDF. The soot primary particles are distinctly smaller in size in IDF (between 19 – 26 nm compared to NDF (between 29–34 nm. Both NDF and IDF show chainlike branched structure of soot agglomerate with soot particles of a nearly spherical shape. The average number of soot primary particles per aggregate in NDF was in the range of 24 to 40 and in IDF it varied between 16 to 24. Soot volume fraction was between 0.6 to 1.5 ppm in NDF where as it was less than 0.2 ppm in IDF. The change in sooting characteristics of the two flame types is attributed to changed fuel/air velocity ratio, entrainment of gas molecules and thermophoresis on soot particles.

An analysis of direct-injection spark-ignition (DISI) soot morphology

Science.gov (United States)

Barone, Teresa L.; Storey, John M. E.; Youngquist, Adam D.; Szybist, James P.

2012-03-01

We have characterized particle emissions produced by a 4-cylinder, 2.0 L DISI engine using transmission electron microscopy (TEM) and image analysis. Analyses of soot morphology provide insight to particle formation mechanisms and strategies for prevention. Particle emissions generated by two fueling strategies were investigated, early injection and injection modified for low particle number concentration emissions. A blend of 20% ethanol and 80% emissions certification gasoline was used for the study given the likelihood of increased ethanol content in widely available fuel. In total, about 200 particles and 3000 primary soot spherules were individually measured. For the fuel injection strategy which produced low particle number concentration emissions, we found a prevalence of single solid sub-25 nm particles and fractal-like aggregates. The modal diameter of single solid particles and aggregate primary particles was between 10 and 15 nm. Solid particles as small as 6 nm were present. Although nanoparticle aggregates had fractal-like morphology similar to diesel soot, the average primary particle diameter per aggregate had a much wider range that spanned from 7 to 60 nm. For the early fuel injection strategy, liquid droplets were prevalent, and the modal average primary particle diameter was between 20 and 25 nm. The presence of liquid droplets may have been the result of unburned fuel and/or lubricating oil originating from fuel impingement on the piston or cylinder wall; the larger modal aggregate primary particle diameter suggests greater fuel-rich zones in-cylinder than for the low particle number concentration point. However, both conditions produced aggregates with a wide range of primary particle diameters, which indicates heterogeneous fuel and air mixing.

Empirical Relationships Between Optical Properties and Equivalent Diameters of Fractal Soot Aggregates at 550 Nm Wavelength.

Science.gov (United States)

Pandey, Apoorva; Chakrabarty, Rajan K.; Liu, Li; Mishchenko, Michael I.

2015-01-01

Soot aggregates (SAs)-fractal clusters of small, spherical carbonaceous monomers-modulate the incoming visible solar radiation and contribute significantly to climate forcing. Experimentalists and climate modelers typically assume a spherical morphology for SAs when computing their optical properties, causing significant errors. Here, we calculate the optical properties of freshly-generated (fractal dimension Df = 1.8) and aged (Df = 2.6) SAs at 550 nm wavelength using the numericallyexact superposition T-Matrix method. These properties were expressed as functions of equivalent aerosol diameters as measured by contemporary aerosol instruments. This work improves upon previous efforts wherein SA optical properties were computed as a function of monomer number, rendering them unusable in practical applications. Future research will address the sensitivity of variation in refractive index, fractal prefactor, and monomer overlap of SAs on the reported empirical relationships.

Investigations of Sooting Laminar Coflow Diffusion Flames at Elevated Pressures

KAUST Repository

Steinmetz, Scott A.

2016-12-01

sizes plateau. Particle size in the annulus is more sensitive to pressure. Next, the development of an alternative particle size measuring technique is studied. Time Resolved Laser Induced Incandescence (TiRe-LII) is a commonly used technique to measure soot concentrations and particle size at atmospheric pressure. However, Laser Induced Incandescence (LII) models suffer from an incomplete understanding of the effects of elevated pressures on the absorption, annealing, and cooling of soot. The present study focuses on what affect the laser temporal pulse shape and duration may have on particle sizing. TiRe-LII in flames at 1 and 15 bar is carried out, using laser pulses with tophat or Gaussian temporal profiles of varying duration. Mono-disperse equivalent primary particle diameters are calculated using the KAUST LII model. Little difference in particle sizing is found for different laser pulses. However, this data will be useful for validating the KAUST LII model when absorption and poly-dispersion are accounted for. In an effort to move one step closer to logistical fuel studies, the sooting tendencies of a number of liquid fuels are studied at pressures up to 10. Of parallel relevance, a sooting index for surrogate development is evaluated for elevated pressure applications. The Yield Sooting Index (YSI) methodology is applied to 11 normal, cyclic, and branched alkanes. When referencing to two n-alkane fuels, the YSI of n-alkanes determined at atmospheric pressures accurately reflects the relative sooting tendencies of these fuels at elevated pressures. The relative sooting tendencies of cyclo- and methyl-alkanes have a lower pressure sensitivity than n-alkanes.

Dynamic properties of polydisperse colloidal particles in the presence of thermal gradient studied by a modified Brownian dynamic model

Science.gov (United States)

Song, Dongxing; Jin, Hui; Jing, Dengwei; Wang, Xin

2018-03-01

Aggregation and migration of colloidal particles under the thermal gradient widely exists in nature and many industrial processes. In this study, dynamic properties of polydisperse colloidal particles in the presence of thermal gradient were studied by a modified Brownian dynamic model. Other than the traditional forces on colloidal particles, including Brownian force, hydrodynamic force, and electrostatic force from other particles, the electrostatic force from the asymmetric ionic diffusion layer under a thermal gradient has been considered and introduced into the Brownian dynamic model. The aggregation ratio of particles (R A), the balance time (t B) indicating the time threshold when {{R}A} becomes constant, the porosity ({{P}BA} ), fractal dimension (D f) and distributions of concentration (DISC) and aggregation (DISA) for the aggregated particles were discussed based on this model. The aggregated structures formed by polydisperse particles are less dense and the particles therein are loosely bonded. Also it showed a quite large compressibility as the increases of concentration and interparticle potential can significantly increase the fractal dimension. The thermal gradient can induce two competitive factors leading to a two-stage migration of particles. When t{{t}B} , the thermophoresis becomes dominant thus the migrations of particles are against the thermal gradient. The effect of thermophoresis on the aggregate structures was found to be similar to the effect of increasing particle concentration. This study demonstrates how the thermal gradient affects the aggregation of monodisperse and polydisperse particles and can be a guide for the biomimetics and precise control of colloid system under the thermal gradient. Moreover, our model can be easily extended to other more complex colloidal systems considering shear, temperature fluctuation, surfactant, etc.

Sooting turbulent jet flame: characterization and quantitative soot measurements

Science.gov (United States)

Köhler, M.; Geigle, K. P.; Meier, W.; Crosland, B. M.; Thomson, K. A.; Smallwood, G. J.

2011-08-01

Computational fluid dynamics (CFD) modelers require high-quality experimental data sets for validation of their numerical tools. Preferred features for numerical simulations of a sooting, turbulent test case flame are simplicity (no pilot flame), well-defined boundary conditions, and sufficient soot production. This paper proposes a non-premixed C2H4/air turbulent jet flame to fill this role and presents an extensive database for soot model validation. The sooting turbulent jet flame has a total visible flame length of approximately 400 mm and a fuel-jet Reynolds number of 10,000. The flame has a measured lift-off height of 26 mm which acts as a sensitive marker for CFD model validation, while this novel compiled experimental database of soot properties, temperature and velocity maps are useful for the validation of kinetic soot models and numerical flame simulations. Due to the relatively simple burner design which produces a flame with sufficient soot concentration while meeting modelers' needs with respect to boundary conditions and flame specifications as well as the present lack of a sooting "standard flame", this flame is suggested as a new reference turbulent sooting flame. The flame characterization presented here involved a variety of optical diagnostics including quantitative 2D laser-induced incandescence (2D-LII), shifted-vibrational coherent anti-Stokes Raman spectroscopy (SV-CARS), and particle image velocimetry (PIV). Producing an accurate and comprehensive characterization of a transient sooting flame was challenging and required optimization of these diagnostics. In this respect, we present the first simultaneous, instantaneous PIV, and LII measurements in a heavily sooting flame environment. Simultaneous soot and flow field measurements can provide new insights into the interaction between a turbulent vortex and flame chemistry, especially since soot structures in turbulent flames are known to be small and often treated in a statistical manner.

Effect of strain rate on sooting limits in counterflow diffusion flames of gaseous hydrocarbon fuels: Sooting temperature index and sooting sensitivity index

KAUST Repository

Wang, Yu

2014-05-01

The effect of the strain rate on the sooting limits in counterflow diffusion flames was investigated in various gaseous hydrocarbon fuels by varying the nitrogen dilution in the fuel and oxidizer streams. The sooting limit was defined as the critical fuel and oxygen mole fraction at which soot started to appear in the elastic light scattering signal. The sooting region for normal alkane fuels at a specified strain rate, in terms of the fuel and oxygen mole fraction, expanded as the number of carbon atoms increased. The alkene fuels (ethylene, propene) tested had a higher propensity for sooting as compared with alkane fuels with the same carbon numbers (ethane, propane). Branched iso-butane had a higher propensity for sooting than did n-butane. An increase in the strain rate reduced the tendency for sooting in all the fuels tested. The sensitivity of the sooting limit to the strain rate was more pronounced for less sooting fuels. When plotted in terms of calculated flame temperature, the critical oxygen mole fraction exhibited an Arrhenius form under sooting limit conditions, which can be utilized to significantly reduce the effort required to determine sooting limits at different strain rates. We found that the limiting temperatures of soot formation flames are viable sooting metrics for quantitatively rating the sooting tendency of various fuels, based on comparisons with threshold soot index and normalized smoke point data. We also introduce a sooting temperature index and a sooting sensitivity index, two quantitative measures to describe sooting propensity and its dependence on strain rate. © 2013 The Combustion Institute.

Large eddy simulation of soot evolution in an aircraft combustor

Science.gov (United States)

Mueller, Michael E.; Pitsch, Heinz

2013-11-01

An integrated kinetics-based Large Eddy Simulation (LES) approach for soot evolution in turbulent reacting flows is applied to the simulation of a Pratt & Whitney aircraft gas turbine combustor, and the results are analyzed to provide insights into the complex interactions of the hydrodynamics, mixing, chemistry, and soot. The integrated approach includes detailed models for soot, combustion, and the unresolved interactions between soot, chemistry, and turbulence. The soot model is based on the Hybrid Method of Moments and detailed descriptions of soot aggregates and the various physical and chemical processes governing their evolution. The detailed kinetics of jet fuel oxidation and soot precursor formation is described with the Radiation Flamelet/Progress Variable model, which has been modified to account for the removal of soot precursors from the gas-phase. The unclosed filtered quantities in the soot and combustion models, such as source terms, are closed with a novel presumed subfilter PDF approach that accounts for the high subfilter spatial intermittency of soot. For the combustor simulation, the integrated approach is combined with a Lagrangian parcel method for the liquid spray and state-of-the-art unstructured LES technology for complex geometries. Two overall fuel-to-air ratios are simulated to evaluate the ability of the model to make not only absolute predictions but also quantitative predictions of trends. The Pratt & Whitney combustor is a Rich-Quench-Lean combustor in which combustion first occurs in a fuel-rich primary zone characterized by a large recirculation zone. Dilution air is then added downstream of the recirculation zone, and combustion continues in a fuel-lean secondary zone. The simulations show that large quantities of soot are formed in the fuel-rich recirculation zone, and, furthermore, the overall fuel-to-air ratio dictates both the dominant soot growth process and the location of maximum soot volume fraction. At the higher fuel

On the formation and early evolution of soot in turbulent nonpremixed flames

KAUST Repository

Bisetti, Fabrizio; Blanquart, Guillaume; Mü eller, Michael E.; Pitsch, Heinz G.

2012-01-01

(2009) 1143-1155], which allows for an accurate state-of-the-art description of soot number density, volume fraction, and morphology of the aggregates. In agreement with previous experimental studies in laminar flames, Damköhler number effects are found

Light scattering and extinction measurements combined with laser-induced incandescence for the real-time determination of soot mass absorption cross section.

Science.gov (United States)

Wei, Yiyi; Ma, Lulu; Cao, Tingting; Zhang, Qing; Wu, Jun; Buseck, Peter R; Thompson, J E

2013-10-01

An aerosol albedometer was combined with laser-induced incandescence (LII) to achieve simultaneous measurements of aerosol scattering, extinction coefficient, and soot mass concentration. Frequency doubling of a Nd:YAG laser line resulted in a colinear beam of both λ = 532 and 1064 nm. The green beam was used to perform cavity ring-down spectroscopy (CRDS), with simultaneous measurements of scattering coefficient made through use of a reciprocal sphere nephelometer. The 1064 nm beam was selected and directed into a second integrating sphere and used for LII of light-absorbing kerosene lamp soot. Thermal denuder experiments showed the LII signals were not affected by the particle mixing state when laser peak power was 1.5-2.5 MW. The combined measurements of optical properties and soot mass concentration allowed determination of mass absorption cross section (M.A.C., m(2)/g) with 1 min time resolution when soot concentrations were in the low microgram per cubic meter range. Fresh kerosene nanosphere soot (ns-soot) exhibited a mean M.A.C and standard deviation of 9.3 ± 2.7 m(2)/g while limited measurements on dry ambient aerosol yielded an average of 8.2 ± 5.9 m(2)/g when soot was >0.25 μg/m(3). The method also detected increases in M.A.C. values associated with enhanced light absorption when polydisperse, laboratory-generated ns-soot particles were embedded within or coated with ammonium nitrate, ammonium sulfate, and glycerol. Glycerol coatings produced the largest fractional increase in M.A.C. (1.41-fold increase), while solid coatings of ammonium sulfate and ammonium nitrate produced increases of 1.10 and 1.06, respectively. Fresh, ns-soot did not exhibit increased M.A.C. at high relative humidity (RH); however, lab-generated soot coated with ammonium nitrate and held at 85% RH exhibited M.A.C. values nearly double the low-humidity case. The hybrid instrument for simultaneously tracking soot mass concentration and aerosol optical properties in real time is a

The single scattering properties of the aerosol particles as aggregated spheres

International Nuclear Information System (INIS)

Wu, Y.; Gu, X.; Cheng, T.; Xie, D.; Yu, T.; Chen, H.; Guo, J.

2012-01-01

The light scattering and absorption properties of anthropogenic aerosol particles such as soot aggregates are complicated in the temporal and spatial distribution, which introduce uncertainty of radiative forcing on global climate change. In order to study the single scattering properties of anthorpogenic aerosol particles, the structures of these aerosols such as soot paticles and soot-containing mixtures with the sulfate or organic matter, are simulated using the parallel diffusion limited aggregation algorithm (DLA) based on the transmission electron microscope images (TEM). Then, the single scattering properties of randomly oriented aerosols, such as scattering matrix, single scattering albedo (SSA), and asymmetry parameter (AP), are computed using the superposition T-matrix method. The comparisons of the single scattering properties of these specific types of clusters with different morphological and chemical factors such as fractal parameters, aspect ratio, monomer radius, mixture mode and refractive index, indicate that these different impact factors can respectively generate the significant influences on the single scattering properties of these aerosols. The results show that aspect ratio of circumscribed shape has relatively small effect on single scattering properties, for both differences of SSA and AP are less than 0.1. However, mixture modes of soot clusters with larger sulfate particles have remarkably important effects on the scattering and absorption properties of aggregated spheres, and SSA of those soot-containing mixtures are increased in proportion to the ratio of larger weakly absorbing attachments. Therefore, these complex aerosols come from man made pollution cannot be neglected in the aerosol retrievals. The study of the single scattering properties on these kinds of aggregated spheres is important and helpful in remote sensing observations and atmospheric radiation balance computations.

Kinetics of Crystallization in Polydisperse Emulsions.

Science.gov (United States)

Kashchiev; Kaneko; Sato

1998-12-01

The kinetics of isothermal crystallization of the droplets in polydisperse emulsions are analyzed under the condition that each emulsion droplet gives birth to one nucleus only. Expressions are derived for the time dependences of the number of crystallized droplets and the fraction of crystallized droplet volume in the cases of either volume or surface nucleation of the crystals in the droplets. The time for half-crystallization is determined as a function of the emulsion polydispersity, and it is found that the more polydisperse the emulsion, the shorter this time in comparison with that for the corresponding monodisperse emulsion. Formulae are also obtained for the change of the velocity Kv of propagation of ultrasound through polydisperse emulsions during the time t of isothermal crystallization of the droplets in them. Good agreement is found between theory and experiment in an analysis of available Kv(t) data for crystallization in polydisperse palm oil-in-water and n-hexadecane-in-water emulsions. The results obtained are directly applicable to devitrification and polymorphic transformation of disperse solid phases. Copyright 1998 Academic Press.

Density functional theory of polydisperse fluid interfaces

International Nuclear Information System (INIS)

Baus, M.; Bellier-Castella, L.; Xu, H.

2002-01-01

Most colloids usually exhibit one or several polydispersities. A natural framework for the theoretical description of polydisperse systems is provided by the extension of density functional theory to 'continuous' mixtures. This will be illustrated here by the study of both the bulk and interfacial properties of a simple van der Waals model for a polydisperse colloidal fluid. (author)

T-matrix modeling of linear depolarization by morphologically complex soot and soot-containing aerosols

Science.gov (United States)

Mishchenko, Michael I.; Liu, Li; Mackowski, Daniel W.

2013-07-01

We use state-of-the-art public-domain Fortran codes based on the T-matrix method to calculate orientation and ensemble averaged scattering matrix elements for a variety of morphologically complex black carbon (BC) and BC-containing aerosol particles, with a special emphasis on the linear depolarization ratio (LDR). We explain theoretically the quasi-Rayleigh LDR peak at side-scattering angles typical of low-density soot fractals and conclude that the measurement of this feature enables one to evaluate the compactness state of BC clusters and trace the evolution of low-density fluffy fractals into densely packed aggregates. We show that small backscattering LDRs measured with ground-based, airborne, and spaceborne lidars for fresh smoke generally agree with the values predicted theoretically for fluffy BC fractals and densely packed near-spheroidal BC aggregates. To reproduce higher lidar LDRs observed for aged smoke, one needs alternative particle models such as shape mixtures of BC spheroids or cylinders.

Morphology and nano-structure analysis of soot particles sampled from high pressure diesel jet flames under diesel-like conditions

Science.gov (United States)

Jiang, Hao; Li, Tie; Wang, Yifeng; He, Pengfei

2018-04-01

Soot particles emitted from diesel engines have a significant impact on the atmospheric environment. Detailed understanding of soot formation and oxidation processes is helpful for reducing the pollution of soot particles, which requires information such as the size and nano-structure parameters of the soot primary particles sampled in a high-temperature and high-pressure diesel jet flame. Based on the thermophoretic principle, a novel sampling probe minimally disturbing the diesel jet flame in a constant volume combustion vessel is developed for analysing soot particles. The injected quantity of diesel fuel is less than 10 mg, and the soot particles sampled by carriers with a transmission electron microscope (TEM) grid and lacey TEM grid can be used to analyse the morphologies of soot aggregates and the nano-structure of the soot primary particles, respectively. When the quantity of diesel fuel is more than 10 mg, in order to avoid burning-off of the carriers in higher temperature and pressure conditions, single-crystal silicon chips are employed. Ultrasonic oscillations and alcohol extraction are then implemented to obtain high quality soot samples for observation using a high-resolution transmission electron microscope. An in-house Matlab-based code is developed to extract the nano-structure parameters of the soot particles. A complete sampling and analysis procedure of the soot particles is provided to study the formation and oxidation mechanism of soot.

Filtration of polydispersed colloids

International Nuclear Information System (INIS)

Nuttall, H.E.

1988-01-01

In this study, the dynamic microscopic form of the population balance model is applied to the problem of polydispersed particle capture in one spatial diffusion. This mathematical modeling approach can be applied to the difficult and potentially important problem of particulate (radiocolloid) transport in the groundwater surrounding a nuclear waste disposal site. To demonstrate the population balance methodology, the equations were developed and used to investigate transport and capture of polydispersed colloids in packed columns. Modeling simulations were compared to experimental column data. The multidimensional form of the population balance equation was used to analyze the transport and capture of polydispersed colloids. A numerical model was developed to describe transport of polydispersed colloids through a one-dimensional porous region. The effects of various size distributions were investigated in terms of capture efficiency. For simulating the column data, it was found by trial and error that as part of the population balance model a linear size dependent filtration function gave a good fit to the measured colloid concentration profile. The effects of constant versus size dependent filtration coefficients were compared and the differences illustrated by the calculated colloid profile within the column. Also observed from the model calculations was the dramatically changing liquid-phase colloid-size distribution which was plotted as a function of position down the column. This modeling approach was excellent for describing and understanding microscopic filtration in porous media

Sooting limit in counterflow diffusion flames of ethylene/propane fuels and implication to threshold soot index

KAUST Repository

Joo, Peter H.

2013-01-01

Sooting limits in counterflow diffusion flames of propane/ethylene fuels have been studied experimentally using a light scattering technique, including the effects of dilution, fuel mixing, and strain rate. The results are discussed in view of the threshold soot index (TSI). In soot-formation (SF) flames, where the flame is located on the oxidizer side of the stagnation plane, the sooting limit depends critically on fuel type and subsequently on flame temperature. The sooting limit has a non-linear dependence on the fuel-mixing ratio, which is similar to the non-linear mixing rule for TSI observed experimentally in rich premixed flames, where soot oxidation is absent for both SF and rich premixed flames. In soot-formation-oxidation (SFO) flames, where the flame is located on the fuel side, the sooting limit depends critically on flame temperature, while it is relatively independent on fuel type. This result suggests a linear mixing rule for sooting limits in SFO flames, which is similar to the TSI behavior for coflow diffusion flames. Soot oxidation takes place for both types of flames. The aerodynamic strain effect on the sooting limits has also been studied and an appreciable influence has been observed. Under sooting conditions, soot volume fraction was measured using a light extinction technique. The soot loadings in SF flames of the mixture fuels demonstrated a synergistic effect, i.e., soot production increased for certain mixture fuels as compared to the respective singlecomponent fuels. © 2012 The Combustion Institute.

Internally mixed soot, sulfates, and organic matter in aerosol particles from Mexico City

Science.gov (United States)

Adachi, K.; Buseck, P. R.

2008-05-01

Soot particles are major aerosol constituents that result from emissions of burning of fossil fuel and biomass. Because they both absorb sunlight and contribute to cloud formation, they are an influence on climate on local, regional, and global scales. It is therefore important to evaluate their optical and hygroscopic properties and those effects on the radiation budget. Those properties commonly change through reaction with other particles or gases, resulting in complex internal mixtures. Using transmission electron microscopy, we measured ~8000 particles (25 samples) with aerodynamic diameters from 0.05 to 0.3 μm that were collected in March 2006 from aircraft over Mexico City (MC) and adjacent areas. More than 50% of the particles consist of internally mixed soot, organic matter, and sulfate. Imaging combined with chemical analysis of individual particles show that many are coated, consist of aggregates, or both. Coatings on soot particles can amplify their light absorption, and coagulation with sulfates changes their hygroscopic properties, resulting in shorter lifetime. Our results suggest that a mixture of materials from multiple sources such as vehicles, power plants, and biomass burning occurs in individual particles, thereby increasing their complexity. Through changes in their optical and hygroscopic properties, internally mixed soot particles have a greater effect on the regional climate than uncoated soot particles. Moreover, soot occurs in more than 60% of all particles in the MC plumes, suggesting its important role in the formation of secondary aerosol particles.

Dynamical study of a polydisperse hard-sphere system

KAUST Repository

Nogawa, Tomoaki

2010-08-10

We study the interplay between the fluid-crystal transition and the glass transition of elastic sphere system with polydispersity using nonequilibrium molecular dynamics simulations. It is found that the end point of the crystal-fluid transition line, which corresponds to the critical polydispersity above which the crystal state is unstable, is on the glass transition line. This means that crystal and fluid states at the melting point becomes less distinguishable as polydispersity increases and finally they become identical state, i.e., marginal glass state, at critical polydispersity. © 2010 The American Physical Society.

Numerical investigation on soot particles emission in compression ignition diesel engine by using particulate mimic soot model

Directory of Open Access Journals (Sweden)

Ibrahim Fadzli

2017-01-01

Full Text Available Research via computational method, specifically by detailed-kinetic soot model offers much more advantages than the simple model as more detailed formation/oxidation process is taken into consideration, thus providing better soot mass concentration, soot size, soot number density as well as information regarding other related species. In the present computational study, investigation of in-cylinder soot concentration as well as other emissions in a single cylinder diesel engine has been conducted, using a commercial multidimensional CFD software, CONVERGE CFD. The simulation was carried out for a close-cycle combustion environment from inlet valve closing (IVC to exhaust valve opening (EVO. In this case, detailed-kinetic Particulate Mimic (PM soot model was implemented as to take benefit of the method of moment, instead of commonly implemented simple soot model. Analyses of the results are successfully plotted to demonstrate that the soot size and soot mass concentration are strongly dependent on the detailed soot formation and oxidation process rates. The calculated of soot mass concentration and average soot size at EVO provide the end value of 29.2 mg/m3 and 2.04 × 10−8 m, respectively. Besides, post-processing using EnSight shows the qualitative results of soot concentration along simulation period in the combustion chamber.

Evaluation of a Lagrangian Soot Tracking Method for the prediction of primary soot particle size under engine-like conditions

DEFF Research Database (Denmark)

Cai Ong, Jiun; Pang, Kar Mun; Walther, Jens Honore

2018-01-01

This paper reports the implementation and evaluation of a Lagrangian soot tracking (LST) method for the modeling of soot in diesel engines. The LST model employed here has the tracking capability of a Lagrangian method and the ability to predict primary soot particle sizing. The Moss-Brookes soot...... in predicting temporal soot cloud development, mean soot diameter and primary soot size distribution is evaluated using measurements of n-heptane and n-dodecane spray combustion obtained under diesel engine-like conditions. In addition, sensitivity studies are carried out to investigate the influence of soot....... A higher rate of soot oxidation due to OH causes the soot particles to be fully oxidized downstream of the flame. In general, the LST model performs better than the Eulerian method in terms of predicting soot sizing and accessing information of individual soot particles, both of which are shortcomings...

Coagulation of Agglomerates Consisting of Polydisperse Primary Particles.

Science.gov (United States)

Goudeli, E; Eggersdorfer, M L; Pratsinis, S E

2016-09-13

The ballistic agglomeration of polydisperse particles is investigated by an event-driven (ED) method and compared to the coagulation of spherical particles and agglomerates consisting of monodisperse primary particles (PPs). It is shown for the first time to our knowledge that increasing the width or polydispersity of the PP size distribution initially accelerates the coagulation rate of their agglomerates but delays the attainment of their asymptotic fractal-like structure and self-preserving size distribution (SPSD) without altering them, provided that sufficiently large numbers of PPs are employed. For example, the standard asymptotic mass fractal dimension, Df, of 1.91 is attained when clusters are formed containing, on average, about 15 monodisperse PPs, consistent with fractal theory and the literature. In contrast, when polydisperse PPs with a geometric standard deviation of 3 are employed, about 500 PPs are needed to attain that Df. Even though the same asymptotic Df and mass-mobility exponent, Dfm, are attained regardless of PP polydispersity, the asymptotic prefactors or lacunarities of Df and Dfm increase with PP polydispersity. For monodisperse PPs, the average agglomerate radius of gyration, rg, becomes larger than the mobility radius, rm, when agglomerates consist of more than 15 PPs. Increasing PP polydispersity increases that number of PPs similarly to the above for the attainment of the asymptotic Df or Dfm. The agglomeration kinetics are quantified by the overall collision frequency function. When the SPSD is attained, the collision frequency is independent of PP polydispersity. Accounting for the SPSD polydispersity in the overall agglomerate collision frequency is in good agreement with that frequency from detailed ED simulations once the SPSD is reached. Most importantly, the coagulation of agglomerates is described well by a monodisperse model for agglomerate and PP sizes, whereas the detailed agglomerate size distribution can be obtained by

Ice Nucleation of Soot Particles in the Cirrus Regime: Is Pore Condensation and Freezing Relevant for Soot?

Science.gov (United States)

Kanji, Z. A.; Mahrt, F.; David, R.; Marcolli, C.; Lohmann, U.; Fahrni, J.; Brühwiler, D.

2017-12-01

Heterogeneous ice nucleation (HIN) onto soot particles from previous studies have produced inconsistent results of temperature and relative humidity conditions required for freezing depending on the source of soot particle investigated. The ability of soot to act as HIN depended on the type of soot and size of particle. Often homogenous freezing conditions or water saturation conditions were required to freeze soot particles, rendering HIN irrelevant. Using synthesised mesoporous silica particles, we show pore condensation and freezing works with experiments performed in the Zurich Ice Nucleation Chamber (ZINC). By testing a variety of soot particles in parallel in the Horizontal Ice Nucleation Chamber (HINC), we suggest that previously observed HIN on soot particles is not the responsible mechanism for ice formation. Laboratory generated CAST brown and black soot, commercially available soot and acid treated soot were investigated for their ice nucleation abilities in the mixed-phase and cirrus cloud temperature regimes. No heterogeneous ice nucleation activity is inferred at T > -38 °C (mixed-phase cloud regime), however depending on particle size and soot type, HIN was observed for T nucleation of ice in the pores or cavities that are ubiquitous in soot particles between the primary spherules. The ability of some particles to freeze at lower relative humidity compared to others demonstrates why hydrophobicity plays a role in ice nucleation, i.e. controlling the conditions at which these cavities fill with water. Thus for more hydrophobic particles pore filling occurs at higher relative humidity, and therefore freezing of pore water and ice crystal growth. Future work focusses on testing the cloud processing ability of soot particles and water adsorption isotherms of the different soot samples to support the hydrophobicity inferences from the ice nucleation results.

Simulation of temporal and spatial soot evolution in an automotive diesel engine using the Moss–Brookes soot model

International Nuclear Information System (INIS)

Pang, Kar Mun; Ng, Hoon Kiat; Gan, Suyin

2012-01-01

Highlights: ► Numerical models were validated against experimental data of two diesel engines. ► Soot model constant values were calibrated to predict in-cylinder soot processes. ► Effects of split-main injection parameters on soot distributions were determined. ► Soot cloud was distributed towards cylinder wall when using large dwell period. ► Greater soot deposition expected with large dwell period and retarded injection. - Abstract: In this reported work, computational study on the formation processes of soot particles from diesel combustion is conducted using an approach where Computational Fluid Dynamics (CFD) is coupled with a chemical kinetic model. A multi-step soot model which accounts for inception, surface growth, coagulation and oxidation was applied. Model constant values in the Moss–Brookes soot formation and Fenimore–Jones soot oxidation models were calibrated, and were validated against in-cylinder soot evolution and exhaust soot density of both heavy- and light-duty diesel engines, respectively. Effects of various injection parameters such as start of injection (SOI) timing, split-main ratio and dwell period of the split-main injection strategy on in-cylinder temporal/spatial soot evolution in a light-duty diesel engine were subsequently investigated. The spatial soot distributions at each crank angle degree after start of injection were found to be insensitive to the change of values in SOI and split-main ratio when close-coupled injection was implemented. Soot cloud was also observed to be distributed towards the cylinder wall when a large separation of 20° was used, even with an advanced SOI timing of −6° after top dead centre (ATDC). The use of large separation is hence not desired for this combustion system as it potentially leads to soot deposition on surface oil film and greater tailpipe soot emissions.

Physical and chemical comparison of soot in hydrocarbon and biodiesel fuel diffusion flames: A study of model and commercial fuels

Energy Technology Data Exchange (ETDEWEB)

Matti Maricq, M. [Research and Advanced Engineering, Ford Motor Company, Dearborn, MI (United States)

2011-01-15

Data are presented to compare soot formation in both surrogate and practical fatty acid methyl ester biodiesel and petroleum fuel diffusion flames. The approach here uses differential mobility analysis to follow the size distributions and electrical charge of soot particles as they evolve in the flame, and laser ablation particle mass spectrometry to elucidate their composition. Qualitatively, these soot properties exhibit a remarkably similar development along the flames. The size distributions begin as a single mode of precursor nanoparticles, evolve through a bimodal phase marking the onset of aggregate formation, and end in a self preserving mode of fractal-like particles. Both biodiesel and hydrocarbon fuels yield a common soot composition dominated by C{sub x}H{sub y}{sup +} ions, stabilomer PAHs, and fullerenes in the positive ion mass spectrum, and C{sub x}{sup -} and C{sub 2x}H{sup -} in the negative ion spectrum. These ion intensities initially grow with height in the diffusion flames, but then decline during later stages, consistent with soot carbonization. There are important quantitative differences between fuels. The surrogate biodiesel fuel methyl butanoate substantially reduces soot levels, but soot formation and evolution in this flame are delayed relative to both soy and petroleum fuels. In contrast, soots from soy and hexadecane flames exhibit nearly quantitative agreement in their size distribution and composition profiles with height, suggesting similar soot precursor chemistry. (author)

Amorphous Calcium Phosphate Formation and Aggregation Process Revealed by Light Scattering Techniques

Directory of Open Access Journals (Sweden)

Vida Čadež

2018-06-01

Full Text Available Amorphous calcium phosphate (ACP attracts attention as a precursor of crystalline calcium phosphates (CaPs formation in vitro and in vivo as well as due to its excellent biological properties. Its formation can be considered to be an aggregation process. Although aggregation of ACP is of interest for both gaining a fundamental understanding of biominerals formation and in the synthesis of novel materials, it has still not been investigated in detail. In this work, the ACP aggregation was followed by two widely applied techniques suitable for following nanoparticles aggregation in general: dynamic light scattering (DLS and laser diffraction (LD. In addition, the ACP formation was followed by potentiometric measurements and formed precipitates were characterized by Fourier transform infrared spectroscopy (FTIR, powder X-ray diffraction (PXRD, transmission electron microscopy (TEM, and atomic force microscopy (AFM. The results showed that aggregation of ACP particles is a process which from the earliest stages simultaneously takes place at wide length scales, from nanometers to micrometers, leading to a highly polydisperse precipitation system, with polydispersity and vol. % of larger aggregates increasing with concentration. Obtained results provide insight into developing a way of regulating ACP and consequently CaP formation by controlling aggregation on the scale of interest.

Fullerene Soot in Eastern China Air: Results from Soot Particle-Aerosol Mass Spectrometer

Science.gov (United States)

Wang, J.; Ge, X.; Chen, M.; Zhang, Q.; Yu, H.; Sun, Y.; Worsnop, D. R.; Collier, S.

2015-12-01

In this work, we present for the first time, the observation and quantification of fullerenes in ambient airborne particulate using an Aerodyne Soot Particle - Aerosol Mass Spectrometer (SP-AMS) deployed during 2015 winter in suburban Nanjing, a megacity in eastern China. The laser desorption and electron impact ionization techniques employed by the SP-AMS allow us to differentiate various fullerenes from other aerosol components. Mass spectrum of the identified fullerene soot is consisted by a series of high molecular weight carbon clusters (up to m/z of 2000 in this study), almost identical to the spectral features of commercially available fullerene soot, both with C70 and C60 clusters as the first and second most abundant species. This type of soot was observed throughout the entire study period, with an average mass loading of 0.18 μg/m3, accounting for 6.4% of the black carbon mass, 1.2% of the total organic mass. Temporal variation and diurnal pattern of fullerene soot are overall similar to those of black carbon, but are clearly different in some periods. Combining the positive matrix factorization, back-trajectory and analyses of the meteorological parameters, we identified the petrochemical industrial plants situating upwind from the sampling site, as the major source of fullerene soot. In this regard, our findings imply the ubiquitous presence of fullerene soot in ambient air of industry-influenced area, especially the oil and gas production regions. This study also offers new insights into the characterization of fullerenes from other environmental samples via the advanced SP-AMS technique.

Dielectric properties of PMMA/Soot nanocomposites.

Science.gov (United States)

Clayton, Lanetra M; Cinke, Martin; Meyyappan, M; Harmon, Julie P

2007-07-01

Dielectric analysis (DEA) of relaxation behavior in poly(methyl methacrylate) (PMMA) soot nanocomposites is described herein. The soot, an inexpensive material, consists of carbon nanotubes, amorphous and graphitic carbon and metal particles. Results are compared to earlier studies on PMMA/multi-walled nanotube (MWNT) composites and PMMA/single-walled nanotube (SWNT) composites. The beta relaxation process appeared to be unaffected by the presence of the soot, as was noted earlier in nanotube composites. The gamma relaxation region in PMMA, normally dielectrically inactive, was "awakened" in the PMMA/soot composite. This occurrence is consistent with previously published data on nanotube composites. The dielectric permittivity, s', increased with soot content. The sample with 1% soot exhibited a permittivity (at 100 Hz and 25 degrees C) of 7.3 as compared to 5.1 for neat PMMA. Soot increased the dielectric strength, deltaE, of the composites. The 1% soot sample exhibited a dielectric strength of 6.38, while the neat PMMA had a value of 2.95 at 40 degrees C. The symmetric broadening term (alpha) was slightly higher for the 1% composite at temperatures near the secondary relaxation and near the primary relaxation, but all samples deviated from symmetrical semi-circular behavior (alpha = 1). The impact of the soot filler is seen more clearly in dielectric properties than in mechanical properties studies conducted earlier.

Crystallization in polydisperse colloidal suspensions

International Nuclear Information System (INIS)

Martin, S.; Bryant, G.; Van Megen, W.

2004-01-01

Full text: Crystallization and glass formation in colloidal hard spheres has been a very active area of research over the last 15-20 years. For most of this time particle polydispersity has been considered to be a minor concern in these studies. However, over the last few years an increasing number of simulations, theoretical work and experiments have shown that consideration of the polydispersity is critical in understanding these phenomena. In this paper we provide an overview of recent crystallization studies on particles with two very different particle size distributions. These particles exhibit very different equilibrium crystal structures and crystallization kinetics. Based on these measurements and time lapse photographs, we propose a growth mechanism whereby crystallization occurs in conjunction with a local fractionation process near the crystal-fluid interface, which significantly alters the kinetics of crystallite nucleation and growth. This fractionation effect becomes more significant as polydispersity or skewness increases. The unusual crystal structures observed are explained using a schematic model that explains the structure in terms of stacks of planes, which are unregistered due to a high incidence of stacking faults caused by the incorporation of a large number of small particles

Electron spin resonance of particulate soot samples from automobiles to help environmental studies

International Nuclear Information System (INIS)

Yamanaka, C.; Matsuda, T.; Ikeya, M.

2005-01-01

The application of electron spin resonance (ESR) was studied for diesel soot samples and suspended particulate matter (SPM) from automobile engines. Soot samples or diesel exhaust particles (DEP) were recovered at various points: in the exhaust pipe of a diesel engine, at the dust sampler of a highway tunnel (standard DEP), on the soundproofing wall alongside a heavy traffic road, and on the filters of a dust sampler for SPM. The diesel soot samples apparently showed two ESR spectra: one was a broad spectrum at g=2.1 with a line width of ca. 80-120mT and the other was a sharp signal of a carbon radical at g=2.003 with a line width of 0.4mT. Annealing experiments with a DEP sample at 250 deg. C revealed drastic enhancement of the sharp ESR signal, which suggested a thermal process of carbonization of remnant organics. An oximetric study by ESR showed an enhancement of the broad signal in the diesel soot sample as well as in the sharp ESR signal. Therefore, the main part of the broad ESR signal would be attributed to carbon radicals, which form a different configuration, probably closely interacting aggregates. Enhancement of the sharp ESR signal was not observed in the standard DEP sample under vacuum condition, which suggested less adsorption sites on the surface of DEP samples

Studies of propane flame soot acting as heterogeneous ice nuclei in conjunction with single particle soot photometer measurements

Directory of Open Access Journals (Sweden)

I. Crawford

2011-09-01

Full Text Available The ice nucleation efficiency of propane flame soot particles with and without a sulphuric acid coating was investigated using the aerosol and cloud chamber facility AIDA (Aerosol Interaction and Dynamics in the Atmosphere. The test soot for cloud formation simulations was produced using a propane flame Combustion Aerosol Standard generator (CAST, Jing-CAST Technologies. The organic carbon content (OC of the test soot was altered in a reproducible fashion by changing the fuel/air mixture of the generator. The soot content of ice nuclei was subsequently investigated using a combination of a pumped counterflow virtual impactor (PCVI to separate and evaporate the ice crystals, and a DMT single particle soot photometer (SP2 to examine the mixing state of the BC containing ice residuals.

Ice nucleation was found to be most efficient for uncoated soot of low organic carbon content (~5 % organic carbon content where deposition freezing occurred at an ice saturation ratio S_ice ~ 1.22 at a temperature T = 226.6 K with 25 % of the test soot becoming active as ice nuclei. Propane flame soot of higher organic carbon content (~30 % and ~70 % organic carbon content showed significantly lower ice nucleation efficiency (an activated fraction of the order of a few percent in the experiments than the low organic carbon content soot, with water saturation being required for freezing to occur. Ice nucleation occurred over the range S_ice = 1.22–1.70, and T = 223.2–226.6 K. Analysis of the SP2 data showed that the 5 % organic carbon content soot had an undetectable OC coating whereas the 30 % organic carbon content soot had a thicker or less volatile OC coating.

The application of a sulphuric acid coating to the flame soot shifted the threshold of the onset of freezing towards that of the homogeneous freezing of sulphuric acid; for the minimum OC flame soot this inhibited nucleation since the

Primary and Aggregate Size Distributions of PM in Tail Pipe Emissions form Diesel Engines

Science.gov (United States)

Arai, Masataka; Amagai, Kenji; Nakaji, Takayuki; Hayashi, Shinji

Particulate matter (PM) emission exhausted from diesel engine should be reduced to keep the clean air environment. PM emission was considered that it consisted of coarse and aggregate particles, and nuclei-mode particles of which diameter was less than 50nm. However the detail characteristics about these particles of the PM were still unknown and they were needed for more physically accurate measurement and more effective reduction of exhaust PM emission. In this study, the size distributions of solid particles in PM emission were reported. PMs in the tail-pipe emission were sampled from three type diesel engines. Sampled PM was chemically treated to separate the solid carbon fraction from other fractions such as soluble organic fraction (SOF). The electron microscopic and optical-manual size measurement procedures were used to determine the size distribution of primary particles those were formed through coagulation process from nuclei-mode particles and consisted in aggregate particles. The centrifugal sedimentation method was applied to measure the Stokes diameter of dry-soot. Aerodynamic diameters of nano and aggregate particles were measured with scanning mobility particle sizer (SMPS). The peak aggregate diameters detected by SMPS were fallen in the same size regime as the Stokes diameter of dry-soot. Both of primary and Stokes diameters of dry-soot decreased with increases of engine speed and excess air ratio. Also, the effects of fuel properties and engine types on primary and aggregate particle diameters were discussed.

Sooting Characteristics and Modeling in Counterflow Diffusion Flames

KAUST Repository

Wang, Yu

2013-11-01

Soot formation is one of the most complex phenomena in combustion science and an understanding of the underlying physico-chemical mechanisms is important. This work adopted both experimental and numerical approaches to study soot formation in laminar counterfl ow diffusion flames. As polycyclic aromatic hydrocarbons (PAHs) are the precursors of soot particles, a detailed gas-phase chemical mechanism describing PAH growth upto coronene for fuels with 1 to 4 carbon atoms was validated against laminar premixed and counter- flow diffusion fl ames. Built upon this gas-phase mechanism, a soot model was then developed to describe soot inception and surface growth. This soot model was sub- sequently used to study fuel mixing effect on soot formation in counterfl ow diffusion flames. Simulation results showed that compared to the baseline case of the ethylene flame, the doping of 5% (by volume) propane or ethane in ethylene tends to increase the soot volume fraction and number density while keeping the average soot size almost unchanged. These results are in agreement with experimental observations. Laser light extinction/scattering as well as laser induced fluorescence techniques were used to study the effect of strain rate on soot and PAH formation in counterfl ow diffusion ames. The results showed that as strain rate increased both soot volume fraction and PAH concentrations decreased. The concentrations of larger PAH were more sensitive to strain rate compared to smaller ones. The effect of CO2 addition on soot formation was also studied using similar experimental techniques. Soot loading was reduced with CO2 dilution. Subsequent numerical modeling studies were able to reproduce the experimental trend. In addition, the chemical effect of CO2 addition was analyzed using numerical data. Critical conditions for the onset of soot were systematically studied in counterfl ow diffusion ames for various gaseous hydrocarbon fuels and at different strain rates. A sooting

Aggregated particles caused by instrument artifact

Science.gov (United States)

Pierce, Ashley M.; Loría-Salazar, S. Marcela; Arnott, W. Patrick; Edwards, Grant C.; Miller, Matthieu B.; Gustin, Mae S.

2018-04-01

Previous studies have indicated that superaggregates, clusters of aggregates of soot primary particles, can be formed in large-scale turbulent fires. Due to lower effective densities, higher porosity, and lower aerodynamic diameters, superaggregates may pass through inlets designed to remove particles 2.5 µm in aerodynamic diameter were collected on 36 out of 158 sample days. On preliminary analysis, it was thought that these aggregated particles were superaggregates, depositing past PM10 (particles wind speeds, as well as the use of generators on site. Samples with aggregated particles, referred to as aggregates, were analyzed using a scanning electron microscope for size and shape and energy dispersive X-ray spectroscopy was used for elemental analysis. It was determined, based on the high amounts of aluminum present in the aggregate samples, that a sampling artifact associated with the sample inlet and prolonged, high wind events was the probable reason for the observed aggregates.

The phase behavior of polydisperse multiblock copolymer melts: (a theoretical study)

OpenAIRE

Angerman, Hindrik Jan

1998-01-01

Summary The main theme of this thesis is the influence of polydispersity on the phase behavior of copolymer melts. With “polydispersity” we do not only refer to polydispersity in overall chain length, but also to polydispersity in the composition and the monomer sequence of the chains. Study of the influence of polydispersity is important because synthesizing purely monodisperse copolymers is very difficult, and for most polymerization techniques the occurrence of a certain degree of polydisp...

Variation in polydispersity in pump- and pressure-driven micro-droplet generators

Science.gov (United States)

Zeng, Wen; Jacobi, Ian; Li, Songjing; Stone, Howard A.

2015-11-01

The polydispersity of droplets produced in a typical T-junction microfluidic channel under both syringe-pump-driven and pressure-driven flow configurations is measured quantitatively. Both flow systems exhibit high-frequency flow fluctuations that result in an intrinsic polydispersity due to the mechanism of droplet generation. In addition to this intrinsic polydispersity, the syringe-pump-driven device also exhibits low-frequency fluctuations due to mechanical oscillations of the pump, which overwhelm the high-frequency flow fluctuations and produce a signficantly heightened level of polydispersity. The quantitative difference in polydispersity between the two configurations and time-resolved measurements of individual droplet sizes are presented in order to enable the design of better flow control systems for droplet production.

The phase behavior of polydisperse multiblock copolymer melts : (a theoretical study)

NARCIS (Netherlands)

Angerman, Hindrik Jan

1998-01-01

Summary The main theme of this thesis is the influence of polydispersity on the phase behavior of copolymer melts. With “polydispersity” we do not only refer to polydispersity in overall chain length, but also to polydispersity in the composition and the monomer sequence of the chains. Study of the

Polydisperse effects in jet spray flames

Science.gov (United States)

Weinberg, Noam; Greenberg, J. Barry

2018-01-01

A laminar jet polydisperse spray diffusion flame is analysed mathematically for the first time using an extension of classical similarity solutions for gaseous jet flames. The analysis enables a comparison to be drawn between conditions for flame stability or flame blow-out for purely gaseous flames and for spray flames. It is found that, in contrast to the Schmidt number criteria relevant to gas flames, droplet size and initial spray polydispersity play a critical role in determining potential flame scenarios. Some qualitative agreement for lift-off height is found when comparing predictions of the theory and sparse independent experimental evidence from the literature.

Soot measurements by two angle scattering and extinction in an N 2 -diluted ethylene/air counterflow diffusion flame from 2 to 5 atm

KAUST Repository

Amin, Hafiz M.F.

2016-06-27

The soot formed in an N-diluted ethylene/air counterflow diffusion flame at elevated pressure was investigated using two angle light scattering/extinction technique. To provide a well-controlled pressurized environment for the flame, a novel pressure vessel was built with the required optical access. The soot parameters were measured along the centerline of the counterflow flame. These properties included soot volume fraction (f ), primary particle diameter (d ), population averaged radius of gyration (R ) and number density of primary particles (n ). The Rayleigh-Debye-Gans theory for Fractal Aggregates (RDG-FA) was used to retrieve these properties from scattering and extinction measurements. Soot volume fraction was measured via light extinction from 2 to 5atm while maintaining the same global strain rate at all pressures. Scattered light from soot particles was measured at 45° and 135° and primary particle diameter was calculated using scattering/extinction ratio and the radius of gyration was determined from the dissymmetry ratio. Soot volume fraction, primary particle diameter and radius of gyration all increased with pressure while the number density of primary particles decreased with increasing pressure.

Soot measurements by two angle scattering and extinction in an N 2 -diluted ethylene/air counterflow diffusion flame from 2 to 5 atm

KAUST Repository

Amin, Hafiz M.F.; Roberts, William L.

2016-01-01

The soot formed in an N-diluted ethylene/air counterflow diffusion flame at elevated pressure was investigated using two angle light scattering/extinction technique. To provide a well-controlled pressurized environment for the flame, a novel pressure vessel was built with the required optical access. The soot parameters were measured along the centerline of the counterflow flame. These properties included soot volume fraction (f ), primary particle diameter (d ), population averaged radius of gyration (R ) and number density of primary particles (n ). The Rayleigh-Debye-Gans theory for Fractal Aggregates (RDG-FA) was used to retrieve these properties from scattering and extinction measurements. Soot volume fraction was measured via light extinction from 2 to 5atm while maintaining the same global strain rate at all pressures. Scattered light from soot particles was measured at 45° and 135° and primary particle diameter was calculated using scattering/extinction ratio and the radius of gyration was determined from the dissymmetry ratio. Soot volume fraction, primary particle diameter and radius of gyration all increased with pressure while the number density of primary particles decreased with increasing pressure.

Effect of Drive Cycle and Gasoline Particulate Filter on the Size and Morphology of Soot Particles Emitted from a Gasoline-Direct-Injection Vehicle.

Science.gov (United States)

Saffaripour, Meghdad; Chan, Tak W; Liu, Fengshan; Thomson, Kevin A; Smallwood, Gregory J; Kubsh, Joseph; Brezny, Rasto

2015-10-06

The size and morphology of particulate matter emitted from a light-duty gasoline-direct-injection (GDI) vehicle, over the FTP-75 and US06 transient drive cycles, have been characterized by transmission-electron-microscope (TEM) image analysis. To investigate the impact of gasoline particulate filters on particulate-matter emission, the results for the stock-GDI vehicle, that is, the vehicle in its original configuration, have been compared to the results for the same vehicle equipped with a catalyzed gasoline particulate filter (GPF). The stock-GDI vehicle emits graphitized fractal-like aggregates over all driving conditions. The mean projected area-equivalent diameter of these aggregates is in the 78.4-88.4 nm range and the mean diameter of primary particles varies between 24.6 and 26.6 nm. Post-GPF particles emitted over the US06 cycle appear to have an amorphous structure, and a large number of nucleation-mode particles, depicted as low-contrast ultrafine droplets, are observed in TEM images. This indicates the emission of a substantial amount of semivolatile material during the US06 cycle, most likely generated by the incomplete combustion of accumulated soot in the GPF during regeneration. The size of primary particles and soot aggregates does not vary significantly by implementing the GPF over the FTP-75 cycle; however, particles emitted by the GPF-equipped vehicle over the US06 cycle are about 20% larger than those emitted by the stock-GDI vehicle. This may be attributed to condensation of large amounts of organic material on soot aggregates. High-contrast spots, most likely solid nonvolatile cores, are observed within many of the nucleation-mode particles emitted over the US06 cycle by the GPF-equipped vehicle. These cores are either generated inside the engine or depict incipient soot particles which are partially carbonized in the exhaust line. The effect of drive cycle and the GPF on the fractal parameters of particles, such as fractal dimension and

Polydispersity-driven topological defects as order-restoring excitations.

Science.gov (United States)

Yao, Zhenwei; Olvera de la Cruz, Monica

2014-04-08

The engineering of defects in crystalline matter has been extensively exploited to modify the mechanical and electrical properties of many materials. Recent experiments on manipulating extended defects in graphene, for example, show that defects direct the flow of electric charges. The fascinating possibilities offered by defects in two dimensions, known as topological defects, to control material properties provide great motivation to perform fundamental investigations to uncover their role in various systems. Previous studies mostly focus on topological defects in 2D crystals on curved surfaces. On flat geometries, topological defects can be introduced via density inhomogeneities. We investigate here topological defects due to size polydispersity on flat surfaces. Size polydispersity is usually an inevitable feature of a large variety of systems. In this work, simulations show well-organized induced topological defects around an impurity particle of a wrong size. These patterns are not found in systems of identical particles. Our work demonstrates that in polydispersed systems topological defects play the role of restoring order. The simulations show a perfect hexagonal lattice beyond a small defective region around the impurity particle. Elasticity theory has demonstrated an analogy between the elementary topological defects named disclinations to electric charges by associating a charge to a disclination, whose sign depends on the number of its nearest neighbors. Size polydispersity is shown numerically here to be an essential ingredient to understand short-range attractions between like-charge disclinations. Our study suggests that size polydispersity has a promising potential to engineer defects in various systems including nanoparticles and colloidal crystals.

Thermal fragmentation and deactivation of combustion-generated soot particles

KAUST Repository

Raj, Abhijeet

2014-09-01

The effect of thermal treatment on diesel soot and on a commercial soot in an inert environment under isothermal conditions at intermediate temperatures (400-900°C) is studied. Two important phenomena are observed in both the soot samples: soot fragmentation leading to its mass loss, and loss of soot reactivity towards O2. Several experimental techniques such as high resolution transmission electron microscopy, electron energy loss spectroscopy, thermo-gravimetric analysis with mass spectrometry, elemental analysis, Fourier transform infrared spectroscopy and X-ray diffraction have been used to identify the changes in structures, functional groups such as oxygenates and aliphatics, σ and π bonding, O/C and H/C ratios, and crystallite parameters of soot particles, introduced by heat. A decrease in the size of primary particles and an increase in the average polycyclic aromatic hydrocarbon (PAH) size was observed in soots after thermal treatment. The activation energies of soot oxidation for thermally treated soot samples were found to be higher than those for the untreated ones at most conversion levels. The cyclic or acyclic aliphatics with sp3 hybridization were present in significant amounts in all the soot samples, but their concentration decreased with thermal treatment. Interestingly, the H/C and the O/C ratios of soot particles increased after thermal treatment, and thus, they do not support the decrease in soot reactivity. The increase in the concentration of oxygenates on soot surface indicate that their desorption from soot surface in the form of CO, CO2 and other oxygenated compounds may not be significant at the temperatures (400-900°C) studied in this work. © 2014 The Combustion Institute.

Stochastic Simulation of Soot Formation Evolution in Counterflow Diffusion Flames

Directory of Open Access Journals (Sweden)

Xiao Jiang

2018-01-01

Full Text Available Soot generally refers to carbonaceous particles formed during incomplete combustion of hydrocarbon fuels. A typical simulation of soot formation and evolution contains two parts: gas chemical kinetics, which models the chemical reaction from hydrocarbon fuels to soot precursors, that is, polycyclic aromatic hydrocarbons or PAHs, and soot dynamics, which models the soot formation from PAHs and evolution due to gas-soot and soot-soot interactions. In this study, two detailed gas kinetic mechanisms (ABF and KM2 have been compared during the simulation (using the solver Chemkin II of ethylene combustion in counterflow diffusion flames. Subsequently, the operator splitting Monte Carlo method is used to simulate the soot dynamics. Both the simulated data from the two mechanisms for gas and soot particles are compared with experimental data available in the literature. It is found that both mechanisms predict similar profiles for the gas temperature and velocity, agreeing well with measurements. However, KM2 mechanism provides much closer prediction compared to measurements for soot gas precursors. Furthermore, KM2 also shows much better predictions for soot number density and volume fraction than ABF. The effect of nozzle exit velocity on soot dynamics has also been investigated. Higher nozzle exit velocity renders shorter residence time for soot particles, which reduces the soot number density and volume fraction accordingly.

NATO Workshop on Soot in Combustion Systems

CERN Document Server

Prado, G

1983-01-01

Our interest in Mulhouse for carbon black and soot began some 30 years ago when J.B. Donnet developed the concept of surface chemistry of carbon and its involvement in interactions with gas, liquid and solid phases. In the late sixties, we began to study soot formation in pyrolytic systems and later on in flames. The idea of organ1z1ng a meeting on soot formation originated some four or five years ago, through discussions among Professor J.B. Howard, Dr. A. D'Alessio and ourselves. At that time the scientific community was becoming aware of the necessity to strictly control soot formation and emission. Being involved in the study of surface properties of carbon black as well as of formation of soot, we realized that the combustion community was not always fully aware of the progress made by the physical-chemists on carbon black. Reciprocally, the carbon specialists were often ignoring the research carried out on soot in flames. One objective of this workshop was to stimulate discussions between these two scie...

Aggregation, sedimentation, dissolution and bioavailability of ...

Science.gov (United States)

To understand their fate and transport in estuarine systems, the aggregation, sedimentation, and dissolution of CdSe quantum dots (QDs) in seawater were investigated. Hydrodynamic size increased from 40 to 60 nm to >1 mm within 1 h in seawater, and the aggregates were highly polydispersed. Their sedimentation rates in seawater were measured to be 4–10 mm/day. Humic acid (HA), further increased their size and polydispersity, and slowed sedimentation. Light increased their dissolution and release of dissolved Cd. The ZnS shell also slowed release of Cd ions. With sufficient light, HA increased the dissolution of QDs, while with low light, HA alone did not change their dissolution. The benthic zone in estuarine systems is the most probable long-term destination of QDs due to aggregation and sedimentation. The bioavailability of was evaluated using the mysid Americamysis bahia. The 7-day LC50s of particulate and dissolved QDs were 290 and 23 μg (total Cd)/L, respectively. For mysids, the acute toxicity appears to be from Cd ions; however, research on the effects of QDs should be conducted with other organisms where QDs may be lodged in critical tissues such as gills or filtering apparatus and Cd ions may be released and delivered directly to those tissues. Because of their increasing use and value to society, cadmium-based quantum dots (QDs) will inevitably find their way into marine systems. In an effort to understand the fate and transport of CdSe QDs in estuar

Ice nucleation activity of diesel soot particles at cirrus relevant temperature conditions: Effects of hydration, secondary organics coating, soot morphology, and coagulation

Science.gov (United States)

Kulkarni, Gourihar; China, Swarup; Liu, Shang; Nandasiri, Manjula; Sharma, Noopur; Wilson, Jacqueline; Aiken, Allison C.; Chand, Duli; Laskin, Alexander; Mazzoleni, Claudio; Pekour, Mikhail; Shilling, John; Shutthanandan, Vaithiyalingam; Zelenyuk, Alla; Zaveri, Rahul A.

2016-04-01

Ice formation by diesel soot particles was investigated at temperatures ranging from -40 to -50°C. Size-selected soot particles were physically and chemically aged in an environmental chamber, and their ice nucleating properties were determined using a continuous flow diffusion type ice nucleation chamber. Bare (freshly formed), hydrated, and compacted soot particles, as well as α-pinene secondary organic aerosol (SOA)-coated soot particles at high relative humidity conditions, showed ice formation activity at subsaturation conditions with respect to water but below the homogeneous freezing threshold conditions. However, SOA-coated soot particles at dry conditions were observed to freeze at homogeneous freezing threshold conditions. Overall, our results suggest that heterogeneous ice nucleation activity of freshly emitted diesel soot particles are sensitive to some of the aging processes that soot can undergo in the atmosphere.

An investigation of late-combustion soot burnout in a DI diesel engine using simultaneous planar imaging of soot and OH radical

Energy Technology Data Exchange (ETDEWEB)

John E. Dec; Peter L. Kelly-Zion

1999-10-01

Diesel engine design continues to be driven by the need to improve performance while at the same time achieving further reductions in emissions. The development of new designs to accomplish these goals requires an understanding of how the emissions are produced in the engine. Laser-imaging diagnostics are uniquely capable of providing this information, and the understanding of diesel combustion and emissions formation has been advanced considerably in recent years by their application. However, previous studies have generally focused on the early and middle stages of diesel combustion. These previous laser-imaging studies do provide important insight into the soot formation and oxidation processes during the main combustion event. They indicate that prior to the end of injection, soot formation is initiated by fuel-rich premixed combustion (equivalence ratio > 4) near the upstream limit of the luminous portion of the reacting fuel jet. The soot is then oxidized at the diffusion flame around the periphery of the luminous plume. Under typical diesel engine conditions, the diffusion flame does not burn the remaining fuel and soot as rapidly as it is supplied, resulting in an expanding region of rich combustion products and soot. This is evident in natural emission images by the increasing size of the luminous soot cloud prior to the end of injection. Hence, the amount of soot in the combustion chamber typically increases until shortly after the end of fuel injection, at which time the main soot formation period ends and the burnout phase begins. Sampling valve and two-color pyrometry data indicate that the vast majority (more than 90%) of the soot formed is oxidized before combustion ends; however, it is generally thought that a small fraction of this soot from the main combustion zones is not consumed and is the source of tail pipe soot emissions.

Soot oxidation over NOx storage catalysts. Activity and deactivation

International Nuclear Information System (INIS)

Krishna, K.; Makkee, M.

2006-01-01

Soot oxidation activity and deactivation of NO x storage and reduction (NSR) catalysts containing Pt, K, and Ba supported on Al 2 O 3 , are studied under a variety of reaction conditions. K-containing catalysts decrease soot oxidation temperature with O 2 alone and the presence of Pt further enhance the activity due to synergetic effect. The active species responsible for synergism on Pt/K-Al 2 O 3 are unstable and cannot be regenerated. Soot oxidation temperature decreases by about 150 o C with NO+O 2 exhaust feed gas and under lean conditions NSR system acts as catalysed soot filter (CSF). The reactions that are mainly responsible for decreasing soot oxidation temperature are: (1) soot oxidation with NO 2 followed by NO recycles to NO 2 , and (2) soot oxidation with O 2 assisted by NO 2 . Only a part of the stored NO x that is decomposed at high temperatures under lean conditions is found to be useful for soot oxidation. NO x storage capacity of NSR catalysts decreases upon ageing under soot oxidising conditions. This will lead to a decreased soot oxidation activity on stored nitrate decomposition. Pt/K-Al 2 O 3 catalyst is more active, but least stable compared with Pt/Ba-Al 2 O 3 . (author)

Soot Formation in Freely-Propagating Laminar Premixed Flames

Science.gov (United States)

Lin, K.-C.; Hassan, M. I.; Faeth, G. M.

1997-01-01

Soot formation within hydrocarbon-fueled flames is an important unresolved problem of combustion science. Thus, the present study is considering soot formation in freely-propagating laminar premixed flames, exploiting the microgravity environment to simplify measurements at the high-pressure conditions of interest for many practical applications. The findings of the investigation are relevant to reducing emissions of soot and continuum radiation from combustion processes, to improving terrestrial and spacecraft fire safety, and to developing methods of computational combustion, among others. Laminar premixed flames are attractive for studying soot formation because they are simple one-dimensional flows that are computationally tractable for detailed numerical simulations. Nevertheless, studying soot-containing burner-stabilized laminar premixed flames is problematical: spatial resolution and residence times are limited at the pressures of interest for practical applications, flame structure is sensitive to minor burner construction details so that experimental reproducibility is not very good, consistent burner behavior over the lengthy test programs needed to measure soot formation properties is hard to achieve, and burners have poor durability. Fortunately, many of these problems are mitigated for soot-containing, freely-propagating laminar premixed flames. The present investigation seeks to extend work in this laboratory for various soot processes in flames by observing soot formation in freely-propagating laminar premixed flames. Measurements are being made at both Normal Gravity (NG) and MicroGravity (MG), using a short-drop free-fall facility to provide MG conditions.

Technical Note: The single particle soot photometer fails to reliably detect PALAS soot nanoparticles

Directory of Open Access Journals (Sweden)

M. Gysel

2012-12-01

Full Text Available The single particle soot photometer (SP2 uses laser-induced incandescence (LII for the measurement of atmospheric black carbon (BC particles. The BC mass concentration is obtained by combining quantitative detection of BC mass in single particles with a counting efficiency of 100% above its lower detection limit. It is commonly accepted that a particle must contain at least several tenths of a femtogram BC in order to be detected by the SP2.

Here we show the result that most BC particles from a PALAS spark discharge soot generator remain undetected by the SP2, even if their BC mass, as independently determined with an aerosol particle mass analyser (APM, is clearly above the typical lower detection limit of the SP2. Comparison of counting efficiency and effective density data of PALAS soot with flame generated soot (combustion aerosol standard burner, CAST, fullerene soot and carbon black particles (Cabot Regal 400R reveals that particle morphology can affect the SP2's lower detection limit. PALAS soot particles are fractal-like agglomerates of very small primary particles with a low fractal dimension, resulting in a very low effective density. Such loosely packed particles behave like "the sum of individual primary particles" in the SP2's laser. Accordingly, most PALAS soot particles remain undetected as the SP2's laser intensity is insufficient to heat the primary particles to their vaporisation temperature because of their small size (D_pp ≈ 5–10 nm. Previous knowledge from pulsed laser-induced incandescence indicated that particle morphology might have an effect on the SP2's lower detection limit, however, an increase of the lower detection limit by a factor of ∼5–10, as reported here for PALAS soot, was not expected.

In conclusion, the SP2's lower detection limit at a certain laser power depends primarily on the total BC mass per particle for compact particles with sufficiently high effective

SIMPLE FLUID IN AN ATTRACTIVE, DISORDERED POLYDISPERSE MATRIX

Directory of Open Access Journals (Sweden)

T.Patsahan

2004-01-01

Full Text Available The extension of the replica Ornstein-Zernike (ROZ equations is applied to the study of the structural properties of a Lennard-Jones fluid confined in an attractive polydisperse disordered matrix. The ROZ equations in combination with the orthogonal polynomial expansions for the correlation functions are used. The radial distribution functions are calculated for the adsorbed fluid at different temperatures. The effect of matrix polydispersity on the excess internal energy is considered in our study as well.

Emissions of soot particles from heat generators

Science.gov (United States)

Lyubov, V. K.; Popov, A. N.; Popova, E. I.

2017-11-01

«Soot carbon» or «Soot» - incomplete combustion or thermal decomposition particulate carbon product of hydrocarbons consisting of particles of various shapes and sizes. Soot particles are harmful substances Class 2 and like a dust dispersed by wind for thousands of kilometers. Soot have more powerful negative factor than carbon dioxide. Therefore, more strict requirements on ecological and economical performance for energy facilities at Arctic areas have to be developed to protect fragile Arctic ecosystems and global climate change from degradation and destruction. Quantity of soot particles in the flue gases of energy facilities is a criterion of effectiveness for organization of the burning process. Some of heat generators do not provide the required energy and environmental efficiency which results in irrational use of energy resources and acute pollution of environment. The paper summarizes the results of experimental study of solid particles emission from wide range of capacity boilers burning different organic fuels (natural gas, fuel oil, coal and biofuels). Special attention is paid to environmental and energy performance of the biofuels combustion. Emissions of soot particles PM2.5 are listed. Structure, composition and dimensions of entrained particles with the use of electronic scanning microscope Zeiss SIGMA VP were also studied. The results reveal an impact of several factors on soot particles emission.

Effect of relative humidity on soot - secondary organic aerosol mixing: A case study from the Soot Aerosol Aging Study (PNNL-SAAS)

Science.gov (United States)

Sharma, N.; China, S.; Zaveri, R. A.; Shilling, J. E.; Pekour, M. S.; Liu, S.; Aiken, A. C.; Dubey, M. K.; Wilson, J. M.; Zelenyuk, A.; OBrien, R. E.; Moffet, R.; Gilles, M. K.; Gourihar, K.; Chand, D.; Sedlacek, A. J., III; Subramanian, R.; Onasch, T. B.; Laskin, A.; Mazzoleni, C.

2014-12-01

Atmospheric processing of fresh soot particles emitted by anthropogenic as well as natural sources alters their physical and chemical properties. For example, fresh and aged soot particles interact differently with incident solar radiation, resulting in different overall radiation budgets. Varying atmospheric chemical and meteorological conditions can result in complex soot mixing states. The Soot Aerosol Aging Study (SAAS) was conducted at the Pacific Northwest National Laboratory in November 2013 and January 2014 as a step towards understanding the evolution of mixing state of soot and its impact on climate-relevant properties. Aging experiments on diesel soot were carried out in a controlled laboratory chamber, and the effects of condensation and coagulation processes were systematically explored in separate sets of experiments. In addition to online measurement of aerosol properties, aerosol samples were collected for offline single particle analysis to investigate the evolution of the morphology, elemental composition and fine structure of sample particles from different experiments. Condensation experiments focused on the formation of α-pinene secondary organic aerosol on diesel soot aerosol seeds. Experiments were conducted to study the aging of soot under dry (RH < 2%) and humid conditions (RH ~ 80%). We present an analysis of the morphology of soot, its evolution, and its correlation with optical properties, as the condensation of α-pinene SOA is carried out for the two different RH conditions. The analysis was performed by using scanning electron microscopy, transmission electron microscopy, scanning transmission x-ray microscopy and atomic force microscopy for single particle characterization. In addition, particle size, mass, composition, shape, and density were characterized in-situ, as a function of organics condensed on soot seeds, using single particle mass spectrometer.

Monte carlo simulation for soot dynamics

KAUST Repository

Zhou, Kun

2012-01-01

A new Monte Carlo method termed Comb-like frame Monte Carlo is developed to simulate the soot dynamics. Detailed stochastic error analysis is provided. Comb-like frame Monte Carlo is coupled with the gas phase solver Chemkin II to simulate soot formation in a 1-D premixed burner stabilized flame. The simulated soot number density, volume fraction, and particle size distribution all agree well with the measurement available in literature. The origin of the bimodal distribution of particle size distribution is revealed with quantitative proof.

Mutagenicity of diesel exhaust soot dispersed in phospholipid surfactants

Energy Technology Data Exchange (ETDEWEB)

Wallace, W.; Keane, M.; Xing, S.; Harrison, J.; Gautam, M.; Ong, T.

1994-06-01

Organics extractable from respirable diesel exhaust soot particles by organic solvents have been known for some time to be direct acting frameshift mutagens in the Ames Salmonella typhimurium histidine reversion assay. Upon deposition in a pulmonary alveolus or respiratory bronchiole, respirable diesel soot particles will contact first the hypophase which is coated by and laden with surfactants. To model interactions of soot and pulmonary surfactant, the authors dispersed soots in vitro in the primary phospholipid pulmonary surfactant dipalmitoyl glycerophosphorylcholine (lecithin) (DPL) in physiological saline. They have shown that diesel soots dispersed in lecithin surfactant can express mutagenic activity, in the Ames assay system using S. typhimurium TA98, comparable to that expressed by equal amounts of soot extracted by dichloromethane/dimethylsulfoxide (DCM/DMSO). Here the authors report additional data on the same system using additional exhaust soots and also using two other phospholipids, dipalmitoyl glycerophosphoryl ethanolamine (DPPE), and dipalmitoyl phosphatidic acid (DPPA), with different ionic character hydrophilic moieties. A preliminary study of the surfactant dispersed soot in an eucaryotic cell test system also is reported.

Lanthanum-promoted copper-based hydrotalcites derived mixed oxides for NO{sub x} adsorption, soot combustion and simultaneous NO{sub x}-soot removal

Energy Technology Data Exchange (ETDEWEB)

Wang, Zhongpeng [School of Resources and Environment, University of Jinan, 106 Jiwei Road, Jinan 250022 (China); Inorganic Chemistry Laboratory, University of Oxford, South Parks Road, Oxford OX1 3QR (United Kingdom); Yan, Xiaotong; Bi, Xinlin; Wang, Liguo [School of Resources and Environment, University of Jinan, 106 Jiwei Road, Jinan 250022 (China); Zhang, Zhaoliang, E-mail: chm_zhangzl@ujn.edu.cn [School of Resources and Environment, University of Jinan, 106 Jiwei Road, Jinan 250022 (China); Jiang, Zheng; Xiao, Tiancun [Inorganic Chemistry Laboratory, University of Oxford, South Parks Road, Oxford OX1 3QR (United Kingdom); Umar, Ahmad [Department of Chemistry, College of Science and Arts, Najran University, P.O. Box 1988, Najran 11001 (Saudi Arabia); Promising Centre for Sensors and Electronic Devices (PCSED), Najran University, P.O. Box 1988, Najran 11001 (Saudi Arabia); Wang, Qiang, E-mail: qiang.wang.ox@gmail.com [College of Environmental Science and Engineering, Beijing Forestry University, 35 Tsinghua East Road, Beijing 100083 (China)

2014-03-01

Graphical abstract: - Highlights: • The addition of La in Cu-based oxides increased the types of active oxygen. • NO{sub x} adsorption, soot oxidation and simultaneous NO{sub x}-soot removal were enhanced. • The possible catalytic mechanism was studied via in situ FTIR analysis. • Soot oxidation was promoted by the NO{sub 2} intermediate. - Abstract: La-promoted Cu-based hydrotalcites derived mixed oxides were prepared and their catalytic activities for NO{sub x} adsorption, soot oxidation, and simultaneous NO{sub x}-soot removal were investigated. The catalysts were characterized by XRD, DTG, BET, FTIR, H2-TPR, TPD and TPO techniques. The oxides catalysts exhibited mesoporous properties with specific surface area of 45–160 m{sup 2}/g. The incorporation of La and Cu decreased the amount of basic sites due to the large decrease in surface areas. Under O{sub 2} atmosphere, La incorporation is dominant for soot oxidation activity, while Cu favors high selectivity to CO{sub 2} formation. A synergetic effect between La and Cu for catalyzed soot oxidation lies in the improved redox property and suitable basicity. The presence of NO in O{sub 2} significantly promoted soot oxidation on the catalysts with the ignition temperature decreased to about 300 °C. In O{sub 2}/NO atmosphere, NO{sub 2} acts as an intermediate which oxidizes soot to CO{sub 2} at a lower temperature with itself reduced to NO or N{sub 2}, contributing to the high catalytic performance in simultaneous removal of NO{sub x} and soot.

Experimental and computational investigation of temperature effects on soot mechanisms

Directory of Open Access Journals (Sweden)

Bi Xiaojie

2014-01-01

Full Text Available Effects of initial ambient temperatures on combustion and soot emission characteristics of diesel fuel were investigated through experiment conducted in optical constant volume chamber and simulation using phenomenological soot model. There are four difference initial ambient temperatures adopted in our research: 1000 K, 900 K, 800 K and 700 K. In order to obtain a better prediction of soot behavior, phenomenological soot model was revised to take into account the soot oxidation feedback on soot number density and good agreement was observed in the comparison of soot measurement and prediction. Results indicated that ignition delay prolonged with the decrease of initial ambient temperature. The heat release rate demonstrated the transition from mixing controlled combustion at high ambient temperature to premixed combustion mode at low ambient temperature. At lower ambient temperature, soot formation and oxidation mechanism were both suppressed. But finally soot mass concentration reduced with decreasing initial ambient temperature. Although the drop in ambient temperature did not cool the mean in-cylinder temperature during the combustion, it did shrink the total area of local high equivalence ratio, in which soot usually generated fast. At 700 K initial ambient temperature, soot emissions were almost negligible, which indicates that sootless combustion might be achieved at super low initial temperature operation conditions.

Melting of polydisperse hard disks

NARCIS (Netherlands)

Pronk, S.; Frenkel, D.

2004-01-01

The melting of a polydisperse hard-disk system is investigated by Monte Carlo simulations in the semigrand canonical ensemble. This is done in the context of possible continuous melting by a dislocation-unbinding mechanism, as an extension of the two-dimensional hard-disk melting problem. We find

Estimating soot emissions from an elevated flare

Science.gov (United States)

Almanza, Victor; Sosa, Gustavo

2009-11-01

Combustion aerosols are one of the major concerns in flaring operations, due to both health and environmental hazards. Preliminary results are presented for a 2D transient simulation of soot formation in a reacting jet with exit velocity of 130 m/s under a 5 m/s crossflow released from a 50 m high elevated flare and a 50 cm nozzle. Combustion dynamics was simulated with OpenFOAM. Gas-phase non-premixed combustion was modeled with the Chalmers PaSR approach and a κ-ɛ turbulence model. For soot formation, Moss model was used and the ISAT algorithm for solving the chemistry. Sulfur chemistry was considered to account for the sourness of the fuel. Gas composition is 10 % H2S and 90 % C2H4. A simplified Glassman reaction mechanism was used for this purpose. Results show that soot levels are sensitive to the sulfur present in the fuel, since it was observed a slight decrease in the soot volume fraction. NSC is the current oxidation model for soot formation. Predicted temperature is high (about 2390 K), perhaps due to soot-radiation interaction is not considered yet, but a radiation model implementation is on progress, as well as an oxidation mechanism that accounts for OH radical. Flame length is about 50 m.

Heterogeneous reaction of SO2 with soot: The roles of relative humidity and surface composition of soot in surface sulfate formation

Science.gov (United States)

Zhao, Yan; Liu, Yongchun; Ma, Jinzhu; Ma, Qingxin; He, Hong

2017-03-01

The conversion of SO2 to sulfates on the surface of soot is still poorly understood. Soot samples with different fractions of unsaturated hydrocarbons and oxygen-containing groups were prepared by combusting n-hexane under well-controlled conditions. The heterogeneous reaction of SO2 with soot was investigated using in situ attenuated total internal reflection infrared (ATR-IR) spectroscopy, ion chromatography (IC) and a flow tube reactor at the ambient pressure and relative humidity (RH). Water promoted SO2 adsorption and sulfate formation at the RH range from 6% to 70%, while exceeded water condensed on soot was unfavorable for sulfate formation due to inhibition of SO2 adsorption when RH was higher than 80%. The surface composition of soot, which was governed by combustion conditions, also played an important role in the heterogeneous reaction of SO2 with soot. This effect was found to greatly depend on RH. At low RH of 6%, soot with the highest fuel/oxygen ratio of 0.162 exhibited a maximum uptake capacity for SO2 because it contained a large amount of aromatic Csbnd H groups, which acted as active sites for SO2 adsorption. At RH of 54%, soot produced with a fuel/oxygen ratio of 0.134 showed the highest reactivity toward SO2 because it contained appropriate amounts of aromatic Csbnd H groups and oxygen-containing groups, subsequently leading to the optimal surface concentrations of both SO2 and water. These results suggest that variation in the surface composition of soot from different sources and/or resulting from chemical aging in the atmosphere likely affects the conversion of SO2 to sulfates.

Investigation of black soot staining in houses

Energy Technology Data Exchange (ETDEWEB)

Fugler, D. [Canada Mortgage and Housing Corp., Ottawa, ON (Canada)

2000-07-01

Air quality investigators are frequently called upon to determine the origin of streaking, staining or soot marks in both new and old homes. Those marks display common characteristics: black marks along baseboards at interior or exterior walls, behind furniture and at doorways; black smudges on window frames and plastic cabinets; and even shadowing of studs on exterior wall drywall in a few cases. In most instances, carbon soot from a combustion source is the culprit. The combustion sources include furnaces, water heaters, fireplaces, gas dryers, gas ranges, smoking, vehicle exhaust and candle burning. Scepticism about candle soot is prevalent among callers. As a result, a study was initiated in homes where occupants burn candles regularly to investigate soot problems. Samples were collected from five homes, and included stained carpets, filters, and swab samples of black dust or soot. All the houses selected for the study had been built within a three-year period. Some samples of candles commonly burned in those homes were burnt in a laboratory. Air quality audits had been performed in the homes and had revealed other potential pollutant sources. Best practices for cost-effective clean up and control of soot were researched in industry information. The tests conducted in the laboratory found materials consistent with candle soot or residue during microscopic investigations, but no link was established with the stained material obtained from the homes. A few tips for homeowners were included concerning candle burning, and tips for builders were also offered. 1 tab.

Candle Soot-Driven Performance Enhancement in Pyroelectric Energy Conversion

Science.gov (United States)

Azad, Puneet; Singh, V. P.; Vaish, Rahul

2018-05-01

We observed substantial enhancement in pyroelectric output with the help of candle soot coating on the surface of lead zirconate titanate (PZT). Candle soot of varying thicknesses was coated by directly exposing pyroelectric material to the candle flame. The open-circuit pyroelectric voltage and closed-circuit pyroelectric current were recorded while applying infrared heating across the uncoated and candle soot-coated samples for different heating and cooling cycles. In comparison to the uncoated sample, the maximum open-circuit voltage improves seven times for the candle soot-coated sample and electric current increases by eight times across a resistance of 10Å. Moreover, the harvested energy is enhanced by 50 times for candle soot-coated sample. Results indicate that candle soot coating is an effective and economic method to improve infrared sensing performance of pyroelectric materials.

Electron Tomography of Nanoparticle Clusters: Implications for Atmospheric Lifetimes and Radiative Forcing of Soot

Science.gov (United States)

vanPoppel, Laura H.; Friedrich, Heiner; Spinsby, Jacob; Chung, Serena H.; Seinfeld, John H.; Buseck, Peter R.

2005-01-01

Nanoparticles are ubiquitous in nature. Their large surface areas and consequent chemical reactivity typically result in their aggregation into clusters. Their chemical and physical properties depend on cluster shapes, which are commonly complex and unknown. This is the first application of electron tomography with a transmission electron microscope to quantitatively determine the three-dimensional (3D) shapes, volumes, and surface areas of nanoparticle clusters. We use soot (black carbon, BC) nanoparticles as an example because it is a major contributor to environmental degradation and global climate change. To the extent that our samples are representative, we find that quantitative measurements of soot surface areas and volumes derived from electron tomograms differ from geometrically derived values by, respectively, almost one and two orders of magnitude. Global sensitivity studies suggest that the global burden and direct radiative forcing of fractal BC are only about 60% of the value if it is assumed that BC has a spherical shape.

Computational Investigation of Soot and Radiation in Turbulent Reacting Flows

Science.gov (United States)

Lalit, Harshad

This study delves into computational modeling of soot and infrared radiation for turbulent reacting flows, detailed understanding of both of which is paramount in the design of cleaner engines and pollution control. In the first part of the study, the concept of Stochastic Time and Space Series Analysis (STASS) as a numerical tool to compute time dependent statistics of radiation intensity is introduced for a turbulent premixed flame. In the absence of high fidelity codes for large eddy simulation or direct numerical simulation of turbulent flames, the utility of STASS for radiation imaging of reacting flows to understand the flame structure is assessed by generating images of infrared radiation in spectral bands dominated by radiation from gas phase carbon dioxide and water vapor using an assumed PDF method. The study elucidates the need for time dependent computation of radiation intensity for validation with experiments and the need for accounting for turbulence radiation interactions for correctly predicting radiation intensity and consequently the flame temperature and NOx in a reacting fluid flow. Comparison of single point statistics of infrared radiation intensity with measurements show that STASS can not only predict the flame structure but also estimate the dynamics of thermochemical scalars in the flame with reasonable accuracy. While a time series is used to generate realizations of thermochemical scalars in the first part of the study, in the second part, instantaneous realizations of resolved scale temperature, CO2 and H2O mole fractions and soot volume fractions are extracted from a large eddy simulation (LES) to carry out quantitative imaging of radiation intensity (QIRI) for a turbulent soot generating ethylene diffusion flame. A primary motivation of the study is to establish QIRI as a computational tool for validation of soot models, especially in the absence of conventional flow field and measured scalar data for sooting flames. Realizations of

Steady State Investigations of DPF Soot Burn Rates and DPF Modeling

DEFF Research Database (Denmark)

Cordtz, Rasmus Lage; Ivarsson, Anders; Schramm, Jesper

2011-01-01

and soot mass concentrations are used as model boundary conditions. An in-house developed raw exhaust gas sampling technique is used to measure the soot concentration upstream the DPF which is also needed to find the DPF soot burn rate. The soot concentration is measured basically by filtering the soot...... characteristics are used to fit model constants of soot and filter properties. Measured DPF gas conversions and soot burn rates are used to fit model activation energies of four DPF regeneration reactions using O2 and NO2 as reactants. Modeled DPF pressure drops and soot burn rates are compared to the steady...... state DPF experiments in the temperature range between 260 and 480 °C. The model widely reproduces the experimental results. Especially the exponential soot burn rate versus temperature is accurately reproduced by the model....

Application of the direct simulation Monte Carlo method to nanoscale heat transfer between a soot particle and the surrounding gas

International Nuclear Information System (INIS)

Yang, M.; Liu, F.; Smallwood, G.J.

2004-01-01

Laser-Induced Incandescence (LII) technique has been widely used to measure soot volume fraction and primary particle size in flames and engine exhaust. Currently there is lack of quantitative understanding of the shielding effect of aggregated soot particles on its conduction heat loss rate to the surrounding gas. The conventional approach for this problem would be the application of the Monte Carlo (MC) method. This method is based on simulation of the trajectories of individual molecules and calculation of the heat transfer at each of the molecule/molecule collisions and the molecule/particle collisions. As the first step toward calculating the heat transfer between a soot aggregate and the surrounding gas, the Direct Simulation Monte Carlo (DSMC) method was used in this study to calculate the heat transfer rate between a single spherical aerosol particle and its cooler surrounding gas under different conditions of temperature, pressure, and the accommodation coefficient. A well-defined and simple hard sphere model was adopted to describe molecule/molecule elastic collisions. A combination of the specular reflection and completely diffuse reflection model was used to consider molecule/particle collisions. The results obtained by DSMC are in good agreement with the known analytical solution of heat transfer rate for an isolated, motionless sphere in the free-molecular regime. Further the DSMC method was applied to calculate the heat transfer in the transition regime. Our present DSMC results agree very well with published DSMC data. (author)

Evaluation method for radiative heat transfer in polydisperse water droplets

International Nuclear Information System (INIS)

Maruyama, Shigenao; Nakai, Hirotaka; Sakurai, Atsushi; Komiya, Atsuki

2008-01-01

Simplifications of the model for nongray radiative heat transfer analysis in participating media comprised of polydisperse water droplets are presented. Databases of the radiative properties for a water droplet over a wide range of wavelengths and diameters are constructed using rigorous Mie theory. The accuracy of the radiative properties obtained from the database interpolation is validated by comparing them with those obtained from the Mie calculations. The radiative properties of polydisperse water droplets are compared with those of monodisperse water droplets with equivalent mean diameters. Nongray radiative heat transfer in the anisotropic scattering fog layer, including direct and diffuse solar irradiations and infrared sky flux, is analyzed using REM 2 . The radiative heat fluxes within the fog layer containing polydisperse water droplets are compared with those in the layer containing monodisperse water droplets. Through numerical simulation of the radiative heat transfer, polydisperse water droplets can be approximated by using the Sauter diameter, a technique that can be useful in several research fields, such as engineering and atmospheric science. Although this approximation is valid in the case of pure radiative transfer problems, the Sauter diameter is reconfirmed to be the appropriate diameter for approximating problems in radiative heat transfer, although volume-length mean diameter shows better accordance in some cases. The CPU time for nongray radiative heat transfer analysis with a fog model is evaluated. It is proved that the CPU time is decreased by using the databases and the approximation method for polydisperse particulate media

Ignition delay and soot oxidative reactivity of MTBE blended diesel fuel

KAUST Repository

Yang, Seung Yeon; Naser, Nimal; Chung, Suk-Ho; Al-Qurashi, Khalid

2014-01-01

Methyl tert-butyl ether (MTBE) was added to diesel fuel to investigate the effect on ignition delay and soot oxidative reactivity. An ignition quality tester (IQT) was used to study the ignition propensity of MTBE blended diesel fuels in a reactive spray environment. The IQT data showed that ignition delay increases linearly as the MTBE fraction increases in the fuel. A four-stroke single cylinder diesel engine was used to generate soot samples for a soot oxidation study. Soot samples were pre-treated using a tube furnace in a nitrogen environment to remove any soluble organic fractions and moisture content. Non-isothermal oxidation of soot samples was conducted using a thermogravimetric analyzer (TGA). It was observed that oxidation of 'MTBE soot' started began at a lower temperature and had higher reaction rate than 'diesel soot' across a range of temperatures. Several kinetic analyses including an isoconversional method and a combined model fitting method were carried out to evaluate kinetic parameters. The results showed that Diesel and MTBE soot samples had similar activation energy but the pre-exponential factor of MTBE soot was much higher than that of the Diesel soot. This may explain why MTBE soot was more reactive than Diesel soot. It is suggested that adding MTBE to diesel fuel is better for DPF regeneration since an MTBE blend can significantly influence the ignition characteristics and, consequently, the oxidative reactivity of soot. Copyright © 2014 SAE International.

Ignition delay and soot oxidative reactivity of MTBE blended diesel fuel

KAUST Repository

Yang, Seung Yeon

2014-04-01

Methyl tert-butyl ether (MTBE) was added to diesel fuel to investigate the effect on ignition delay and soot oxidative reactivity. An ignition quality tester (IQT) was used to study the ignition propensity of MTBE blended diesel fuels in a reactive spray environment. The IQT data showed that ignition delay increases linearly as the MTBE fraction increases in the fuel. A four-stroke single cylinder diesel engine was used to generate soot samples for a soot oxidation study. Soot samples were pre-treated using a tube furnace in a nitrogen environment to remove any soluble organic fractions and moisture content. Non-isothermal oxidation of soot samples was conducted using a thermogravimetric analyzer (TGA). It was observed that oxidation of \\'MTBE soot\\' started began at a lower temperature and had higher reaction rate than \\'diesel soot\\' across a range of temperatures. Several kinetic analyses including an isoconversional method and a combined model fitting method were carried out to evaluate kinetic parameters. The results showed that Diesel and MTBE soot samples had similar activation energy but the pre-exponential factor of MTBE soot was much higher than that of the Diesel soot. This may explain why MTBE soot was more reactive than Diesel soot. It is suggested that adding MTBE to diesel fuel is better for DPF regeneration since an MTBE blend can significantly influence the ignition characteristics and, consequently, the oxidative reactivity of soot. Copyright © 2014 SAE International.

NASA: Black soot fuels global warming

CERN Multimedia

2003-01-01

New research from NASA's Goddard Space Center scientists suggests emissions of black soot have been altering the way sunlight reflects off Earth's snow. The research indicates the soot could be responsible for as much as 25 percent of global warming over the past century (assorted news items, 1 paragraph each).

Method for removing soot from exhaust gases

Science.gov (United States)

Suib, Steven L.; Dharmarathna, D. A. Saminda; Pahalagedara, Lakshitha R.

2018-01-16

A method for oxidizing soot from diesel exhaust gas from a diesel engine. The method involves providing a diesel particulate filter for receiving the diesel exhaust gas; coating a catalyst composition on the diesel particulate filter; and contacting the soot from the diesel exhaust gas with the catalyst coated diesel particulate filter at a temperature sufficient to oxidize the soot to carbon dioxide. The catalyst composition is a doped or undoped manganese oxide octahedral molecular sieve (OMS-2) material. A diesel exhaust gas treatment system that includes a diesel particulate filter for receiving diesel exhaust gas from a diesel engine and collecting soot; and a catalyst composition coated on the diesel particulate filter. The catalyst composition is a doped or undoped manganese oxide octahedral molecular sieve (OMS-2).

Strain rate effect on sooting characteristics in laminar counterflow diffusion flames

KAUST Repository

Wang, Yu

2016-01-20

The effects of strain rate, oxygen enrichment and fuel type on the sooting characteristics of counterflow diffusion flames were studied. The sooting structures and relative PAH concentrations were measured with laser diagnostics. Detailed soot modeling using recently developed PAH chemistry and surface reaction mechanism was performed and the results were compared with experimental data for ethylene flames, focusing on the effects of strain rates. The results showed that increase in strain rate reduced soot volume fraction, average size and peak number density. Increase in oxygen mole fraction increased soot loading and decreased its sensitivity on strain rate. The soot volume fractions of ethane, propene and propane flames were also measured as a function of global strain rate. The sensitivity of soot volume fraction to strain rate was observed to be fuel dependent at a fixed oxygen mole fraction, with the sensitivity being higher for more sooting fuels. However, when the soot loadings were matched at a reference strain rate for different fuels by adjusting oxygen mole fraction, the dependence of soot loading on strain rate became comparable among the tested fuels. PAH concentrations were shown to decrease with increase in strain rate and the dependence on strain rate is more pronounced for larger PAHs. Soot modeling was performed using detailed PAH growth chemistry with molecular growth up to coronene. A qualitative agreement was obtained between experimental and simulation results, which was then used to explain the experimentally observed strain rate effect on soot growth. However, quantitatively, the simulation result exhibits higher sensitivity to strain rate, especially for large PAHs and soot volume fractions.

A mobile system for a comprehensive online-characterization of nanoparticle aggregates based on wide-angle light scattering and laser-induced incandescence

Energy Technology Data Exchange (ETDEWEB)

Huber, Franz J. T.; Will, Stefan, E-mail: stefan.will@fau.de [Lehrstuhl für Technische Thermodynamik (LTT), Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Erlangen 91058 (Germany); Erlangen Graduate School in Advanced Optical Technologies (SAOT), Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Erlangen 91052 (Germany); Cluster of Excellence Engineering of Advanced Materials (EAM), Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Erlangen 91052 (Germany); Altenhoff, Michael [Lehrstuhl für Technische Thermodynamik (LTT), Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Erlangen 91058 (Germany); Erlangen Graduate School in Advanced Optical Technologies (SAOT), Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Erlangen 91052 (Germany)

2016-05-15

A mobile demonstrator for the comprehensive online-characterization of gas-borne nanoparticle aggregates is presented. Two optical measurement techniques are combined, both utilizing a pulsed Nd:YAG laser as light source. Aggregate size and fractal dimension are measured by Wide-Angle Light Scattering (WALS). An ellipsoidal mirror images elastically scattered light from scattering angles between 10° and 165° onto a CCD-camera chip resulting in an almost complete scattering diagram with high angular resolution. Primary particle size and volume fraction are measured by time-resolved Laser-Induced Incandescence (TiRe-LII). Here, particles are heated up to about 3000 K by the short laser pulse, the enhanced thermal radiation signal is detected with gated photomultiplier tubes. Analysis of the signal decay time and maximum LII-signal allows for the determination of primary particle diameter and volume fraction. The performance of the system is demonstrated by combined measurements on soot nanoparticle aggregates from a soot aerosol generator. Particle and aggregate sizes are varied by using different equivalence ratios of the combustion in the generator. Soot volume fraction can be adjusted by different levels of dilution with air. Online-measurements were carried out demonstrating the favorable performance of the system and the potential for industrial applications such as process control and product development. The particle properties obtained are confirmed through transmission electron microscopy analysis on representative samples.

A mobile system for a comprehensive online-characterization of nanoparticle aggregates based on wide-angle light scattering and laser-induced incandescence

International Nuclear Information System (INIS)

Huber, Franz J. T.; Will, Stefan; Altenhoff, Michael

2016-01-01

A mobile demonstrator for the comprehensive online-characterization of gas-borne nanoparticle aggregates is presented. Two optical measurement techniques are combined, both utilizing a pulsed Nd:YAG laser as light source. Aggregate size and fractal dimension are measured by Wide-Angle Light Scattering (WALS). An ellipsoidal mirror images elastically scattered light from scattering angles between 10° and 165° onto a CCD-camera chip resulting in an almost complete scattering diagram with high angular resolution. Primary particle size and volume fraction are measured by time-resolved Laser-Induced Incandescence (TiRe-LII). Here, particles are heated up to about 3000 K by the short laser pulse, the enhanced thermal radiation signal is detected with gated photomultiplier tubes. Analysis of the signal decay time and maximum LII-signal allows for the determination of primary particle diameter and volume fraction. The performance of the system is demonstrated by combined measurements on soot nanoparticle aggregates from a soot aerosol generator. Particle and aggregate sizes are varied by using different equivalence ratios of the combustion in the generator. Soot volume fraction can be adjusted by different levels of dilution with air. Online-measurements were carried out demonstrating the favorable performance of the system and the potential for industrial applications such as process control and product development. The particle properties obtained are confirmed through transmission electron microscopy analysis on representative samples.

Determination of the spectral behaviour of atmospheric soot using different particle models

Science.gov (United States)

Skorupski, Krzysztof

2017-08-01

In the atmosphere, black carbon aggregates interact with both organic and inorganic matter. In many studies they are modeled using different, less complex, geometries. However, some common simplification might lead to many inaccuracies in the following light scattering simulations. The goal of this study was to compare the spectral behavior of different, commonly used soot particle models. For light scattering simulations, in the visible spectrum, the ADDA algorithm was used. The results prove that the relative extinction error δCext, in some cases, can be unexpectedly large. Therefore, before starting excessive simulations, it is important to know what error might occur.

Durable superhydrophobic carbon soot coatings for sensor applications

Science.gov (United States)

Esmeryan, K. D.; Radeva, E. I.; Avramov, I. D.

2016-01-01

A novel approach for the fabrication of durable superhydrophobic (SH) carbon soot coatings used in quartz crystal microbalance (QCM) based gas or liquid sensors is reported. The method uses modification of the carbon soot through polymerization of hexamethyldisiloxane (HMDSO) by means of glow discharge RF plasma. The surface characterization shows a fractal-like network of carbon nanoparticles with diameter of ~50 nm. These particles form islands and cavities in the nanometer range, between which the plasma polymerized hexamethyldisiloxane (PPHMDSO) embeds and binds to the carbon chains and QCM surface. Such modified surface structure retains the hydrophobic nature of the soot and enhances its robustness upon water droplet interactions. Moreover, it significantly reduces the insertion loss and dynamic resistance of the QCM compared to the commonly used carbon soot/epoxy resin approach. Furthermore, the PPHMDSO/carbon soot coating demonstrates durability and no aging after more than 40 probing cycles in water based liquid environments. In addition, the surface layer keeps its superhydrophobicity even upon thermal annealing up to 540 °C. These experiments reveal an opportunity for the development of soot based SH QCMs with improved electrical characteristics, as required for high-resolution gas or liquid measurements.

Polydispersity effects in the crystallisation of hard-sphere colloidal samples

International Nuclear Information System (INIS)

Martin, S.; Bryant, G.

2002-01-01

Full text: Colloidal particles mimicking hard-sphere behaviour have been shown to undergo the freezing and melting transition as predicted from computer simulations. Due to the large size and slow movement of the colloidal particles, it is possible to measure the time dependence of the growth of the main Bragg reflection using laser light scattering. The new data presented here was taken on a newly built crystallisation spectrometer which averages the Bragg reflections over the whole Debye-Scherrer cone, where previous work has mostly been done with the detector fixed in one plane. This new apparatus allows us to observe the crystallisation process at earlier times, on lower density samples than had previously been possible. Measurements have been made on samples made from colloidal particles with radii 320nm and 247 nm and polydispersities of ∼6.9% and >8% respectively. The results have been compared with other results from particles with >4% polydispersity. The results show that increasing the polydispersity in the particles increases the time lag before significant crystal growth occurs, but polydispersity doesn't appear to directly affect the rate of crystal growth

Role of field-induced nanostructures, zippering and size polydispersity on effective thermal transport in magnetic fluids without significant viscosity enhancement

Science.gov (United States)

Vinod, Sithara; Philip, John

2017-12-01

Magnetic nanofluids or ferrofluids exhibit extraordinary field dependant tunable thermal conductivity (k), which make them potential candidates for microelectronic cooling applications. However, the associated viscosity enhancement under an external stimulus is undesirable for practical applications. Further, the exact mechanism of heat transport and the role of field induced nanostructures on thermal transport is not clearly understood. In this paper, through systematic thermal, rheological and microscopic studies in 'model ferrofluids', we demonstrate for the first time, the conditions to achieve very high thermal conductivity to viscosity ratio. Highly stable ferrofluids with similar crystallite size, base fluid, capping agent and magnetic properties, but with slightly different size distributions, are synthesized and characterized by X-ray diffraction, small angle X-ray scattering, transmission electron microscopy, dynamic light scattering, vibrating sample magnetometer, Fourier transform infrared spectroscopy and thermo-gravimetry. The average hydrodynamic diameters of the particles were 11.7 and 10.1 nm and the polydispersity indices (σ), were 0.226 and 0.151, respectively. We observe that the system with smaller polydispersity (σ = 0.151) gives larger k enhancement (130% for 150 G) as compared to the one with σ = 0.226 (73% for 80 G). Further, our results show that dispersions without larger aggregates and with high density interfacial capping (with surfactant) can provide very high enhancement in thermal conductivity, with insignificant viscosity enhancement, due to minimal interfacial losses. We also provide experimental evidence for the effective heat conduction (parallel mode) through a large number of space filling linear aggregates with high aspect ratio. Microscopic studies reveal that the larger particles act as nucleating sites and facilitate lateral aggregation (zippering) of linear chains that considerably reduces the number density of space

Flow-induced coalescence in polydisperse systems

Czech Academy of Sciences Publication Activity Database

Fortelný, Ivan; Jůza, Josef

2014-01-01

Roč. 299, č. 10 (2014), s. 1213-1219 ISSN 1438-7492 R&D Projects: GA ČR GAP106/11/1069 Institutional support: RVO:61389013 Keywords : coalescence * polymer blends * polydisperse droplets Subject RIV: BK - Fluid Dynamics Impact factor: 2.661, year: 2014

Aromatics Oxidation and Soot Formation in Flames

Energy Technology Data Exchange (ETDEWEB)

Howard, J. B.; Richter, H.

2005-03-29

This project is concerned with the kinetics and mechanisms of aromatics oxidation and the growth process to polycyclic aromatic hydrocarbons (PAH) of increasing size, soot and fullerenes formation in flames. The overall objective of the experimental aromatics oxidation work is to extend the set of available data by measuring concentration profiles for decomposition intermediates such as phenyl, cyclopentadienyl, phenoxy or indenyl radicals which could not be measured with molecular-beam mass spectrometry to permit further refinement and testing of benzene oxidation mechanisms. The focus includes PAH radicals which are thought to play a major role in the soot formation process while their concentrations are in many cases too low to permit measurement with conventional mass spectrometry. The radical species measurements are used in critical testing and improvement of a kinetic model describing benzene oxidation and PAH growth. Thermodynamic property data of selected species are determined computationally, for instance using density functional theory (DFT). Potential energy surfaces are explored in order to identify additional reaction pathways. The ultimate goal is to understand the conversion of high molecular weight compounds to nascent soot particles, to assess the roles of planar and curved PAH and relationships between soot and fullerenes formation. The specific aims are to characterize both the high molecular weight compounds involved in the nucleation of soot particles and the structure of soot including internal nanoscale features indicative of contributions of planar and/or curved PAH to particle inception.

Dynamics of flow–soot interaction in wrinkled non-premixed ethylene–air flames

KAUST Repository

Arias, Paul G.

2015-08-17

A two-dimensional simulation of a non-premixed ethylene–air flame was conducted by employing a detailed gas-phase reaction mechanism considering polycyclic aromatic hydrocarbons, an aerosol-dynamics-based soot model using a method of moments with interpolative closure, and a grey gas and soot radiation model using the discrete transfer method. Interaction of the sooting flame with a prescribed decaying random velocity field was investigated, with a primary interest in the effects of velocity fluctuations on the flame structure and the associated soot formation process for a fuel-strip configuration and a composition with mature soot growth. The temporally evolving simulation revealed a multi-layered soot formation process within the flame, at a level of detail not properly described by previous studies based on simplified soot models utilizing acetylene or naphthalene precursors for initial soot inception. The overall effect of the flame topology on the soot formation was found to be consistent with previous experimental studies, while a unique behaviour of localised strong oxidation was also noted. The imposed velocity fluctuations led to an increase of the scalar dissipation rate in the sooting zone, causing a net suppression in the soot production rate. Considering the complex structure of the soot formation layer, the effects of the imposed fluctuations vary depending on the individual soot reactions. For the conditions under study, the soot oxidation reaction was identified as the most sensitive to the fluctuations and was mainly responsible for the local suppression of the net soot production. © 2015 Taylor & Francis

Formation of Soot in Counterflow Diffusion Flames with Carbon Dioxide Dilution

KAUST Repository

Wang, Yu

2016-05-04

Experimental and numerical modeling studies have been performed to investigate the effect of CO2 dilution on soot formation in ethylene counterflow diffusion flames. Thermal and chemical effects of CO2 addition on soot growth was numerically identified by using a fictitious CO2 species, which was treated as inert in terms of chemical reactions. The results showed that CO2 addition reduces soot formation both thermodynamically and chemically. In terms of chemical effect, the addition of CO2 decreases soot formation through various pathways, including: (1) reduced soot precursor (PAH) formation leading to lower inception rates and soot number density, which in turn results in lower surface area for soot mass addition; (2) reduced H, CH3, and C3H3 concentrations causing lower H abstraction rate and therefore less active site per surface area for soot growth; and (3) reduced C2H2 mole fraction and thus a slower C2H2 mass addition rate. In addition, the sooting limits were also measured for ethylene counterflow flames in both N2 and CO2 atmosphere and the results showed that sooting region was significantly reduced in the CO2 case compared to the N2 case. © 2016 Taylor & Francis.

Stable generator of polydisperse aerosol

Czech Academy of Sciences Publication Activity Database

Mikuška, Pavel

2001-01-01

Roč. 32, Suppl. 1 (2001), s. S823-S824 ISSN 0021-8502. [European Aerosol Conference 2001. Leipzig, 03.09.2001-07.09.2001] R&D Projects: GA AV ČR IAA4031105 Institutional research plan: CEZ:AV0Z4031919 Keywords : aerosol generator * fine aerosol * polydisperse aerosol Subject RIV: CB - Analytical Chemistry, Separation Impact factor: 1.605, year: 2001

On the Response of Nascent Soot Nanostructure and Oxidative Reactivity to Photoflash Exposure

Directory of Open Access Journals (Sweden)

Wei Wang

2017-07-01

Full Text Available Soot particles are a kind of major pollutant from fuel combustion. To enrich the understanding of soot, this work focuses on investigating detailed influences of instantaneous external irradiation (conventional photoflash exposure on nanostructure as well as oxidation reactivity of nascent soot particles. By detailed soot characterizations flash can reduce the mass of soot and soot nanostructure can be reconstructed substantially without burning. After flash, the degree of soot crystallization increases while the soot reactive rate decreases and the activation energy increases. In addition, nanostructure and oxidative reactivity of soot in air and Ar after flash are different due to their different thermal conductivities.

Heterogeneous dissolution kinetics as a method of the granulometric analysis of polydispersed solids

International Nuclear Information System (INIS)

Melichar, F.; Pourova, D.; Simova, L.; Zvonickova, J.

1976-05-01

The principles of determining the granulometric composition of polydisperse solids from kinetic data on the solubilities thereof are given in the theoretical part of the report. The conditions are stated under which characteristic curves (equations) may be determined. These equations define the relationship between the dissolved polydisperse fraction and the relative decrease of the characteristic size of the polydisperse particles. The characteristic curves are specific for the given granulometric polydispersion state. The experimentally determined characteristic curves, which are expressed analytically by means of an equivalent function, are analyzed using three independent methods, which make it possible to determine the granulometric composition of the dissolved polydispersion: the method of the ''reversed geometrical model'', the Akselrud model method, the granulometric atlas method. The granulometric compositions determined by these methods are compared and discussed. The methods proposed may be considered as further applicable methods in the granulometric particle analysis within the size range of 1 to 700 μm defining predominantly the granulometric spectrum of the primary dispersion, i.e. the deagglomerated particles. (author)

Soot modeling of counterflow diffusion flames of ethylene-based binary mixture fuels

KAUST Repository

Wang, Yu

2015-03-01

A soot model was developed based on the recently proposed PAH growth mechanism for C1-C4 gaseous fuels (KAUST PAH Mechanism 2, KM2) that included molecular growth up to coronene (A7) to simulate soot formation in counterflow diffusion flames of ethylene and its binary mixtures with methane, ethane and propane based on the method of moments. The soot model has 36 soot nucleation reactions from 8 PAH molecules including pyrene and larger PAHs. Soot surface growth reactions were based on a modified hydrogen-abstraction-acetylene-addition (HACA) mechanism in which CH3, C3H3 and C2H radicals were included in the hydrogen abstraction reactions in addition to H atoms. PAH condensation on soot particles was also considered. The experimentally measured profiles of soot volume fraction, number density, and particle size were well captured by the model for the baseline case of ethylene along with the cases involving mixtures of fuels. The simulation results, which were in qualitative agreement with the experimental data in the effects of binary fuel mixing on the sooting structures of the measured flames, showed in particular that 5% addition of propane (ethane) led to an increase in the soot volume fraction of the ethylene flame by 32% (6%), despite the fact that propane and ethane are less sooting fuels than is ethylene, which is in reasonable agreement with experiments of 37% (14%). The model revealed that with 5% addition of methane, there was an increase of 6% in the soot volume fraction. The average soot particle sizes were only minimally influenced while the soot number densities were increased by the fuel mixing. Further analysis of the numerical data indicated that the chemical cross-linking effect between ethylene and the dopant fuels resulted in an increase in PAH formation, which led to higher soot nucleation rates and therefore higher soot number densities. On the other hand, the rates of soot surface growth per unit surface area through the HACA mechanism were

Characterization and reactivity of soot from fast pyrolysis of lignocellulosic compounds and monolignols

DEFF Research Database (Denmark)

Trubetskaya, Anna; Brown, Avery; Tompsett, Geoffrey

2018-01-01

spectroscopy. The CO2 reactivity of soot was investigated by thermogravimetric analysis. Soot from cellulose was more reactive than soot produced from extractives, lignin and monolignols. Soot reactivity was correlated with the separation distances between adjacent graphene layers, as measured using...... transmission electron microscopy. Particle size, free radical concentration, differences in a degree of curvature and multi-core structures influenced the soot reactivity less than the interlayer separation distances. Soot yield was correlated with the lignin content of the feedstock. The selection...... of the extraction solvent had a strong influence on the soot reactivity. The Soxhlet extraction of softwood and wheat straw lignin soot using methanol decreased the soot reactivity, whereas acetone extraction had only a modest effect....

Small particles big effect? - Investigating ice nucleation abilities of soot particles

Science.gov (United States)

Mahrt, Fabian; David, Robert O.; Lohmann, Ulrike; Stopford, Chris; Wu, Zhijun; Kanji, Zamin A.

2017-04-01

Atmospheric soot particles are primary particles produced by incomplete combustion of biomass and/or fossil fuels. Thus soot mainly originates from anthropogenic emissions, stemming from combustion related processes in transport vehicles, industrial and residential uses. Such soot particles are generally complex mixtures of black carbon (BC) and organic matter (OM) (Bond et al., 2013; Petzold et al., 2013), depending on the sources and the interaction of the primary particles with other atmospheric matter and/or gases BC absorbs solar radiation having a warming effect on global climate. It can also act as a heterogeneous ice nucleating particle (INP) and thus impact cloud-radiation interactions, potentially cooling the climate (Lohmann, 2002). Previous studies, however, have shown conflicting results concerning the ice nucleation ability of soot, limiting the ability to predict its effects on Earth's radiation budget. Here we present a laboratory study where we systematically investigate the ice nucleation behavior of different soot particles. Commercial soot samples are used, including an amorphous, industrial carbon frequently used in coatings and coloring (FW 200, Orion Engineered Carbons) and a fullerene soot (572497 ALDRICH), e.g. used as catalyst. In addition, we use soot generated from a propane flame Combustion Aerosol Standard Generator (miniCAST, JING AG), as a proxy for atmospheric soot particles. The ice nucleation ability of these soot types is tested on size-selected particles for a wide temperature range from 253 K to 218 K, using the Horizontal Ice Nucleation Chamber (HINC), a Continuous Flow Diffusion Chamber (CFDC) (Kanji and Abbatt, 2009). Ice nucleation results from these soot surrogates will be compared to chemically more complex real world samples, collected on filters. Filters will be collected during the 2016/2017 winter haze periods in Beijing, China and represent atmospheric soot particles with sources from both industrial and residential

Domain size polydispersity effects on the structural and dynamical properties in lipid monolayers with phase coexistence

Science.gov (United States)

Rufeil-Fiori, Elena; Banchio, Adolfo J.

Lipid monolayers with phase coexistence are a frequently used model for lipid membranes. In these systems, domains of the liquid-condensed phase always present size polydispersity. However, very few theoretical works consider size distribution effects on the monolayer properties. Because of the difference in surface densities, domains have excess dipolar density with respect to the surrounding liquid expanded phase, originating a dipolar inter-domain interaction. This interaction depends on the domain area, and hence the presence of a domain size distribution is associated with interaction polydispersity. Inter-domain interactions are fundamental to understanding the structure and dynamics of the monolayer. For this reason, it is expected that polydispersity significantly alters monolayer properties. By means of Brownian dynamics simulations, we study the radial distribution function (RDF), the average mean square displacement and the average time-dependent self-diffusion coefficient, D(t), of lipid monolayers with normal distributed size domains. It was found that polydispersity strongly affects the value of the interaction strength obtained, which is greatly underestimated if polydispersity is not considered. However, within a certain range of parameters, the RDF obtained from a polydisperse model can be well approximated by that of a monodisperse model, suitably fitting the interaction strength, even for 40% polydispersities. For small interaction strengths or small polydispersities, the polydisperse systems obtained from fitting the experimental RDF have an average mean square displacement and D(t) in good agreement with that of the monodisperse system.

Reductions of PAH and Soot by Center Air Injection

Directory of Open Access Journals (Sweden)

Kazuhiro Yamamoto

2014-07-01

Full Text Available In this study, to reduce the amount of pollutant PAH and soot in the flame, we examined the burner system equipped with a center air injection. For this purpose, by using PAH-LIF and soot LII, we evaluated relative PAH and soot amounts in both the triple port burner and the conventional co-axial burner (double port burner to discuss effects of center air injection on the formation of PAH and soot. The fuel was propane. In the triple port burner, two different blue flames are observed near the burner rim, followed by bright luminous flames with soot. The flame length is longer when the fuel flow velocity is increased. On the other hand, the flame length is shorter with an increase in internal air flow velocity. As for PAH and soot, these amounts of the triple port burner are much smaller than those of the double port burner. For the triple port burner, due to the center air injection, the fuel consumption occurs in both inner and outer flames. On the other hand, for the double port burner, the oxygen is supplied from one side air, and as a result, the fuel consumption rate is relatively lower. Hence, by the center air injection, the fuel consumption is largely accelerated, resulting in the reduction of PAH and soot.

Understanding and predicting soot generation in turbulent non-premixed jet flames.

Energy Technology Data Exchange (ETDEWEB)

Wang, Hai (University of Southern California, Los Angeles, CA); Kook, Sanghoon; Doom, Jeffrey; Oefelein, Joseph Charles; Zhang, Jiayao; Shaddix, Christopher R.; Schefer, Robert W.; Pickett, Lyle M.

2010-10-01

This report documents the results of a project funded by DoD's Strategic Environmental Research and Development Program (SERDP) on the science behind development of predictive models for soot emission from gas turbine engines. Measurements of soot formation were performed in laminar flat premixed flames and turbulent non-premixed jet flames at 1 atm pressure and in turbulent liquid spray flames under representative conditions for takeoff in a gas turbine engine. The laminar flames and open jet flames used both ethylene and a prevaporized JP-8 surrogate fuel composed of n-dodecane and m-xylene. The pressurized turbulent jet flame measurements used the JP-8 surrogate fuel and compared its combustion and sooting characteristics to a world-average JP-8 fuel sample. The pressurized jet flame measurements demonstrated that the surrogate was representative of JP-8, with a somewhat higher tendency to soot formation. The premixed flame measurements revealed that flame temperature has a strong impact on the rate of soot nucleation and particle coagulation, but little sensitivity in the overall trends was found with different fuels. An extensive array of non-intrusive optical and laser-based measurements was performed in turbulent non-premixed jet flames established on specially designed piloted burners. Soot concentration data was collected throughout the flames, together with instantaneous images showing the relationship between soot and the OH radical and soot and PAH. A detailed chemical kinetic mechanism for ethylene combustion, including fuel-rich chemistry and benzene formation steps, was compiled, validated, and reduced. The reduced ethylene mechanism was incorporated into a high-fidelity LES code, together with a moment-based soot model and models for thermal radiation, to evaluate the ability of the chemistry and soot models to predict soot formation in the jet diffusion flame. The LES results highlight the importance of including an optically-thick radiation

Polydispersity effect on solid-fluid transition in hard sphere systems

KAUST Repository

Nogawa, T.

2010-02-01

The solid-fluid transition of the hard elastic particle system with size polydispersity is studied by molecular dynamics simulations. Using nonequilibrium relaxation from the mixed initial condition we determines the melting point where the first order transition between the solid, fcc crystal, and fluid states occurs. It is found that the density gap between the bistable states decreases with increasing the strength of the polydispersity and continuously approaches to zero at the critical point. © 2010.

Soot emissions from turbulent diffusion flames burning simple alkane fuels

Energy Technology Data Exchange (ETDEWEB)

Canteenwalla, P.M.; Johnson, M.R. [Carleton Univ., Ottawa, ON (Canada). Dept. of Mechanical and Aerospace Engineering; Thomson, K.A.; Smallwood, G.J. [National Research Council of Canada, Ottawa, ON (Canada). Inst. for Chemical Process and Environmental Technology

2007-07-01

A classic problem in combustion involves measurement and prediction of soot emissions from turbulent diffusion flames. Very high-sensitivity measurements of particulate matter (PM) from very low-sooting diffusion flames burning methane and other simple alkane fuels have been enabled from recent advances in laser-induced incandescence (LII). In order to quantify soot emissions from a lab-scale turbulent diffusion flame burner, this paper presented a study that used LII to develop a sampling protocol. The purpose of the study was to develop an experimentally based model to predict PM emissions from flares used in industry using soot emissions from lab-scale flares. Quantitative results of mass of soot emitted per mass of fuel burned were presented across a range of flow conditions and fuels. The experiment used digital imaging to measure flame lengths and estimate flame residence times. Comparisons were also made between current measurements and results of previous researchers for soot in the overfire region. The study also considered the validity applicability of buoyancy based models for predicting and scaling soot emissions. The paper described the experimental setup including sampling system and flame length imaging. Background information on soot yield and a comparison of flame residence time definitions were provided. The results and discussion of results were also presented. It was concluded that the results highlighted the subjective nature of flame length measurements. 10 refs., 4 figs.

Potassium and soot interaction in fast biomass pyrolysis at high temperatures

DEFF Research Database (Denmark)

Trubetskaya, Anna; Hofmann Larsen, Flemming; Shchukarev, Andrey

2018-01-01

2 reactivity was studied by thermogravimetric analysis. The XPS results showed that potassium incorporation with oxygen-containing surface groups in the soot matrix did not occur during high temperature pyrolysis. The potassium was mostly found as water-soluble salts such as KCl, KOH, KHCO3 and K2CO...... potassium amount was incorporated in the soot matrix during pyrolysis. Raman spectroscopy results showed that the carbon chemistry of biomass soot also affected the CO2 reactivity. The less reactive pinewood soot was more graphitic than herbaceous biomass soot samples with the disordered carbon structure...

High-throughput approach to the catalytic combustion of diesel soot

Energy Technology Data Exchange (ETDEWEB)

Iojoiu, Eduard Emil; Bassou, Badr; Guilhaume, Nolven; Farrusseng, David; Desmartin-Chomel, Arnold; Bianchi, Daniel; Mirodatos, Claude [Institut de recherches sur la catalyse et l' environnement de Lyon IRCELYON, UMR5256 CNRS Universite Lyon 1, 2 avenue Albert Einstein, F-69626 Villeurbanne Cedex (France); Lombaert, Karine [Renault, Diesel Innovative Catalytic Materials, Direction de l' Ingenierie Materiaux, 1 Allee Cornuel, 91510 Lardy (France)

2008-08-30

A methodology for the evaluation of diesel soot oxidation catalysts by high-throughput (HT) screening was developed. The optimal experimental conditions (soot amount, catalyst/soot ratio, type of contact, composition and flow rate of gas reactants) ensuring a reliable and reproducible detection of light-off temperatures in a 16 parallel channels reactor were set up. The temperature profile measured in the catalyst/soot bed under TPO conditions when the exothermic combustion of soot takes place was shown to provide an accurate measurement of the ignition. Its reproducibility and relevance were checked. The results obtained with a reference noble metal free catalyst (La{sub 0.8}Cr{sub 0.8}Li{sub 0.2}O{sub 3} perovskite) agree very well with literature data. Qualitative mechanistic features could be derived from these experiments, stressing the likely limiting step of oxygen transfer from catalyst surface to soot particulates to ignite the soot combustion. Ceria material was shown to be more appropriate than perovskite one. From an HT screening of a large diverse library (over 100 mixed oxides catalysts) under optimized conditions, about 10 new formulations were found to perform better than selected noble metal free reference materials. (author)

Isothermal Kinetics of Catalyzed Air Oxidation of Diesel Soot

Directory of Open Access Journals (Sweden)

R. Prasad

2011-01-01

Full Text Available To comply with the stringent emission regulations on soot, diesel vehicles manufacturers more and more commonly use diesel particulate filters (DPF. These systems need to be regenerated periodically by burning soot that has been accumulated during the loading of the DPF. Design of the DPF requires rate of soot oxidation. This paper describes the kinetics of catalytic oxidation of diesel soot with air under isothermal conditions. Kinetics data were collected in a specially designed mini-semi-batch reactor. Under the high air flow rate assuming pseudo first order reaction the activation energy of soot oxidation was found to be, Ea = 160 kJ/ mol. ©2010 BCREC UNDIP. All rights reserved(Received: 14th June 2010, Revised: 18th July 2010, Accepted: 9th August 2010[How to Cite: R. Prasad, V.R. Bella. (2010. Isothermal Kinetics of Catalyzed Air Oxidation of Diesel Soot. Bulletin of Chemical Reaction Engineering and Catalysis, 5(2: 95-101. doi:10.9767/bcrec.5.2.796.95-101][DOI:http://dx.doi.org/10.9767/bcrec.5.2.796.95-101 || or local:  http://ejournal.undip.ac.id/index.php/bcrec/article/view/796]Cited by in: ACS 1 |

Topological investigation of electronic silicon nanoparticulate aggregates using ultra-small-angle X-ray scattering

International Nuclear Information System (INIS)

Jonah, E. O.; Britton, D. T.; Beaucage, P.; Rai, D. K.; Beaucage, G.; Magunje, B.; Ilavsky, J.; Scriba, M. R.; Härting, M.

2012-01-01

The network topology of two types of silicon nanoparticles, produced by high energy milling and pyrolysis of silane, in layers deposited from inks on permeable and impermeable substrates has been quantitatively characterized using ultra-small-angle X-ray scattering, supported by scanning electron microscopy observations. The milled particles with a highly polydisperse size distribution form agglomerates, which in turn cluster to form larger aggregates with a very high degree of aggregation. Smaller nanoparticles with less polydisperse size distribution synthesized by thermal catalytic pyrolysis of silane form small open clusters. The Sauter mean diameters of the primary particles of the two types of nanoparticles were obtained from USAXS particle volume to surface ratio, with values of ∼41 and ∼21 nm obtained for the high energy milled and pyrolysis samples, respectively. Assuming a log-normal distribution of the particles, the geometric standard deviation of the particles was calculated to be ∼1.48 for all the samples, using parameters derived from the unified fit to the USAXS data. The flow properties of the inks and substrate combination lead to quantitative changes in the mean particle separation, with slowly curing systems with good capillary flow resulting in denser networks with smaller aggregates and better contact between particles.

Modeling of the (liquid + liquid) equilibrium of polydisperse hyperbranched polymer solutions by lattice-cluster theory

International Nuclear Information System (INIS)

Enders, Sabine; Browarzik, Dieter

2014-01-01

Graphical abstract: - Highlights: • Calculation of the (liquid + liquid) equilibrium of hyperbranched polymer solutions. • Description of branching effects by the lattice-cluster theory. • Consideration of self- and cross association by chemical association models. • Treatment of the molar-mass polydispersity by the use of continuous thermodynamics. • Improvement of the theoretical results by the incorporation of polydispersity. - Abstract: The (liquid + liquid) equilibrium of solutions of hyperbranched polymers of the Boltorn type is modeled in the framework of lattice-cluster theory. The association effects are described by the chemical association models CALM (for self association) and ECALM (for cross association). For the first time the molar mass polydispersity of the hyperbranched polymers is taken into account. For this purpose continuous thermodynamics is applied. Because the segment-molar excess Gibbs free energy depends on the number average of the segment number of the polymer the treatment is more general than in previous papers on continuous thermodynamics. The polydispersity is described by a generalized Schulz–Flory distribution. The calculation of the cloud-point curve reduces to two equations that have to be numerically solved. Conditions for the calculation of the spinodal curve and of the critical point are derived. The calculated results are compared to experimental data taken from the literature. For Boltorn solutions in non-polar solvents the polydispersity influence is small. In all other of the considered cases polydispersity influences the (liquid + liquid) equilibrium considerably. However, association and polydispersity influence phase equilibrium in a complex manner. Taking polydispersity into account the accuracy of the calculations is improved, especially, in the diluted region

Soot Formation in Laminar Premixed Methane/Oxygen Flames at Atmospheric Pressure

Science.gov (United States)

Xu, F.; Lin, K.-C.; Faeth, G. M.

1998-01-01

Flame structure and soot formation were studied within soot-containing laminar premixed mc1hane/oxygen flames at atmospheric pressure. The following measurements were made: soot volume fractions by laser extinction, soot temperatures by multiline emission, gas temperatures (where soot was absent) by corrected fine-wire thermocouples, soot structure by thermophoretic sampling and transmission electron microscope (TEM), major gas species concentrations by sampling and gas chromatography, and gas velocities by laser velocimetry. Present measurements of gas species concentrations were in reasonably good agreement with earlier measurements due to Ramer et al. as well as predictions based on the detailed mechanisms of Frenklach and co-workers and Leung and Lindstedt: the predictions also suggest that H atom concentrations are in local thermodynamic equilibrium throughout the soot formation region. Using this information, it was found that measured soot surface growth rates could be correlated successfully by predictions based on the hydrogen-abstraction/carbon-addition (HACA) mechanisms of both Frenklach and co-workers and Colket and Hall, extending an earlier assessment of these mechanisms for premixed ethylene/air flames to conditions having larger H/C ratios and acetylene concentrations. Measured primary soot particle nucleation rates were somewhat lower than the earlier observations for laminar premixed ethylene/air flames and were significantly lower than corresponding rates in laminar diffusion flames. for reasons that still must be explained.

Soot formation characteristics of gasoline surrogate fuels in counterflow diffusion flames

KAUST Repository

Choi, Byungchul

2011-01-01

The characteristics of polycyclic aromatic hydrocarbon (PAH) and soot for gasoline surrogate fuels have been investigated in counterflow diffusion flames by adopting laser-induced fluorescence (LIF) and laser-induced incandescence (LII) techniques for both soot formation and soot formation/oxidation flames. Tested fuels were three binary mixtures from the primary reference fuels of n-heptane, iso-octane, and toluene. The result showed that PAH and soot maintained near zero level for all mixtures of n-heptane/iso-octane case under present experimental conditions. For n-heptane/toluene and iso-octane/toluene mixtures, PAH initially increased and then decreased with the toluene ratio, exhibiting a synergistic effect. The soot formation increased monotonically with the toluene ratio, however the effect of toluene on soot formation was minimal for relatively small toluene ratios. These results implied that even though toluene had a dominant role in soot and PAH formations, small amount of toluene had a minimal effect on soot formation. Numerical simulations have also been conducted by adopting recently proposed two kinetic mechanisms. The synergistic behavior of aromatic rings was predicted similar to the experimental PAH measurement, however, the degree of the synergistic effect was over-predicted for the soot formation flame, indicating the need for refinements in the kinetic mechanisms. © 2010 Published by Elsevier Inc. on behalf of The Combustion Institute. All rights reserved.

Strain rate effect on sooting characteristics in laminar counterflow diffusion flames

KAUST Repository

Wang, Yu; Chung, Suk-Ho

2016-01-01

The effects of strain rate, oxygen enrichment and fuel type on the sooting characteristics of counterflow diffusion flames were studied. The sooting structures and relative PAH concentrations were measured with laser diagnostics. Detailed soot

Soot in the air may have serious climatic consequences

International Nuclear Information System (INIS)

Seip, Hans Martin

2002-01-01

Emissions of soot in China and India may be an important cause of changed summer weather in China, with increasing floods in the south-east and increasing droughts in the north-east. In addition to the greenhouse gases, the particulate matter (aerosols) in the air has an important effect on the climate. Most particles have a cooling effect since they reflect solar radiation. However, some particles are dark as they contain soot ('black carbon'). Such particles, which are formed by incomplete combustion of coal, oil and biomass, absorb solar radiation and thus have a warming effect, even if they reduce the solar irradiation on the ground. Soot particles do not have quite the same effect as the greenhouse gases. The soot particles absorb solar radiation, while the greenhouse gases absorb terrestrial heat radiation. In addition, the residence time of the soot particles in the atmosphere is shorter than that of, say, carbon dioxide. The concentration is therefore much higher in areas close to emission sources than elsewhere

Morphology and Chemical Composition of soot particles emitted by Wood-burning Cook-Stoves: a HRTEM, XPS and Elastic backscattering Studies.

Science.gov (United States)

Carabali-Sandoval, G. A., Sr.; Castro, T.; Peralta, O.; De la Cruz, W.; Días, J.; Amelines, O.; Rivera-Hernández, M.; Varela, A.; Muñoz-Muñoz, F.; Policroniades, R.; Murillo, G.; Moreno, E.

2014-12-01

The morphology, microstructure and the chemical composition on surface of soot particles were studied by using high resolution transmission electron microscopy (HRTEM), X-ray photoelectron spectroscopy (XPS) and elastic backscattering spectrometry. In order to obtain freshly soot particles emitted by home-made wood-burning cook stoves, copper grids for Transmission Electron Microscope (TEM) were placed on the last two of an 8-stages MOUDI cascade impactor. The analysis of HRTEM micrographs revealed the nanostructure and the particle size of soot particles. The XPS survey spectra show a large carbon peak around 285 eV and the oxygen signal at 533 eV. Some differences observed in the carbon/oxygen (C/O) ratio of the particles probably depend on the combustion process efficiency of each cook-stove analyzed. The C-1s XPS spectra show an asymmetric broad peak and other with low intensity that corresponds to sp2 and sp3hybridization, which were fitted with a convolution using Gaussian functions. Elastic backscattering technique allows a chemical elemental analysis of samples and confirms the presence of C, O and Si observed by XPS. Additionally, the morphological properties of soot aggregates were analyzed calculating the border-based fractal dimension (Df). Particles exhibit complex shapes with high values of Df. Also, real-time absorption (σabs) and scattering (σsct) coefficients of fine (with aerodynamic diameter < 2.5 µm) soot particles were measured. The trend in σabs and σsct indicate that the cooking process has two important combustion stages which varied in its flaming strength, being vigorous in the first stage and soft in the second one.

Cosmic: Carbon Monoxide And Soot In Microgravity Inverse Combustion

Science.gov (United States)

Mikofski, M. A.; Blevins, L. G.; Davis, R. W.; Moore, E. F.; Mulholland, G. W.; Sacksteder, Kurt (Technical Monitor)

2003-01-01

Almost seventy percent of fire related deaths are caused by the inhalation of toxins such as CO and soot that are produced when fires become underventilated.(1) Although studies have established the importance of CO formation during underventilated burning,(2) the formation processes of CO (and soot) in underventilated fires are not well understood. The goal of the COSMIC project is to study the formation processes of CO and soot in underventilated flames. A potential way to study CO and soot production in underventilated flames is the use of inverse diffusion flames (IDFs). An IDF forms between a central air jet and a surrounding fuel jet. IDFs are related to underventilated flames because they may allow CO and soot to escape unoxidized. Experiments and numerical simulations of laminar IDFs of CH4 and C2H4 were conducted in 1-g and micro-g to study CO and soot formation. Laminar flames were studied because turbulent models of underventilated fires are uncertain. Microgravity was used to alter CO and soot pathways. A IDF literature survey, providing background and establishing motivation for this research, was presented at the 5th IWMC.(3) Experimental results from 1-g C2H4 IDFs and comparisons with simulations, demonstrating similarities between IDFs and underventilated fires, were presented at the 6th IWMC.(4) This paper will present experimental results from micro-g and 1-g IDFs of CH4 and C2H4 as well as comparisons with simulations, further supporting the relation between IDFs and underventilated flames.

Quasiuniversal Connectedness Percolation of Polydisperse Rod Systems

NARCIS (Netherlands)

Nigro, B.; Grimaldi, C.; Chatterjee, A.P.; van der Schoot, P. P. A. M.

2013-01-01

The connectedness percolation threshold (ηc) and critical coordination number (Zc) of systems of penetrable spherocylinders characterized by a length polydispersity are studied by way of Monte Carlo simulations for several aspect ratio distributions. We find that (i) ηc is a nearly universal

Diesel soot oxidation under controlled conditions

OpenAIRE

Song, Haiwen

2003-01-01

This thesis was submitted for the degree of Doctor of Philosophy and awarded by Brunel University, 11/12/2003. In order to improve understanding of diesel soot oxidation, an experimental rig was designed and set up, in which the soot oxidation conditions, such as temperature, oxygen partial pressure, and CO2 partial pressure, could be varied independently of each other. The oxidizing gas flow in the oxidizer was under laminar condition. This test rig comprised a naturally-aspirated single ...

ParPor: Particles in Pores. Stochastic Modeling of Polydisperse Transport

DEFF Research Database (Denmark)

Yuan, Hao

2010-01-01

Liquid flow containing particles in the different types of porous media appear in a large variety of practically important industrial and natural processes. The project aims at developing a stochastic model for the deep bed filtration process in which the polydisperse suspension flow...... in the polydisperse porous media. Instead of the traditional parabolic Advection-Dispersion Equation (ADE) the novel elliptic PDE based on the Continuous Time Random Walk is adopted for the particle size kinetics. The pore kinetics is either described by the stochastic size exclusion mechanism or the incomplete pore...

Phototransformation rate constants of PAHs associated with soot particles

International Nuclear Information System (INIS)

Kim, Daekyun; Young, Thomas M.; Anastasio, Cort

2013-01-01

Photodegradation is a key process governing the residence time and fate of polycyclic aromatic hydrocarbons (PAHs) in particles, both in the atmosphere and after deposition. We have measured photodegradation rate constants of PAHs in bulk deposits of soot particles illuminated with simulated sunlight. The photodegradation rate constants at the surface (k p 0 ), the effective diffusion coefficients (D eff ), and the light penetration depths (z 0.5 ) for PAHs on soot layers of variable thickness were determined by fitting experimental data with a model of coupled photolysis and diffusion. The overall disappearance rates of irradiated low molecular weight PAHs (with 2–3 rings) on soot particles were influenced by fast photodegradation and fast diffusion kinetics, while those of high molecular weight PAHs (with 4 or more rings) were apparently controlled by either the combination of slow photodegradation and slow diffusion kinetics or by very slow diffusion kinetics alone. The value of z 0.5 is more sensitive to the soot layer thickness than the k p 0 value. As the thickness of the soot layer increases, the z 0.5 values increase, but the k p 0 values are almost constant. The effective diffusion coefficients calculated from dark experiments are generally higher than those from the model fitting method for illumination experiments. Due to the correlation between k p 0 and z 0.5 in thinner layers, D eff should be estimated by an independent method for better accuracy. Despite some limitations of the model used in this study, the fitted parameters were useful for describing empirical results of photodegradation of soot-associated PAHs. - Highlights: ► PAHs on soot were evaluated by a model of coupled photolysis and diffusion. ► Photodegradation rate at the surface, diffusion coefficient, and light penetration path were determined. ► Low MW PAHs were influenced by fast photodegradation and fast diffusion. ► High MW PAHs were controlled either by slow

Effect of Energy Polydispersity on the Nature of Lennard-Jones Liquids

OpenAIRE

Ingebrigtsen, Trond S.; Tanaka, Hajime

2016-01-01

In the companion paper [T. S. Ingebrigtsen and H. Tanaka, J. Phys. Chem. B 119, 11052 (2015)] the effect of size polydispersity on the nature of Lennard-Jones (LJ) liquids, which represent most molecular liquids without hydrogen bonds, was studied. More specifically, it was shown that even highly size polydisperse LJ liquids are Roskilde-simple (RS) liquids. RS liquids are liquids with strong correlation between constant volume equilibrium fluctuations of virial and potential energy and are s...

Effect of Dimethyl Ether Mixing on Soot Size Distribution in Premixed Ethylene Flame

KAUST Repository

Li, Zepeng

2016-04-21

As a byproduct of incomplete combustion, soot attracts increasing attentions as extensive researches exploring serious health and environmental effects from soot particles. Soot emission reduction requires a comprehensive understanding of the mechanism for polycyclic aromatic hydrocarbons and of soot formation and aging processes. Therefore, advanced experimental techniques and numerical simulations have been conducted to investigate this procedure. In order to investigate the effects of dimethyl ether (DME) mixing on soot particle size distribution functions (PSDFs), DME was mixed in premixed ethylene/oxygen/argon at flames at the equivalence ratio of 2.0 with a range of mixing ratio from 0% to 30% of the total carbon fed. Two series of atmospheric pressure flames were tested in which cold gas velocity was varied to obtain different flame temperatures. The evolution of PSDFs along the centerline of the flame was determined by burner stabilized stagnation probe and scanning mobility particle sizer (SMPS) techniques, yielding the PSDFs for various separation distances above the burner surface. Meanwhile, the flame temperature profiles were carefully measured by a thermocouple and the comparison to that of simulated laminar premixed burner-stabilized stagnation flame was satisfactory. Additionally, to understand the chemical role of DME mixing in soot properties, characterization measurements were conducted on soot samples using thermo-gravimetric analysis (TGA) and elemental analysis (EA). Results of the evolution of PSDFs and soot volume fraction showed that adding DME into ethylene flame could reduce soot yield significantly. The addition of DME led to the decrease of both the soot nucleation rate and the particle mass growth rate. To explain the possible mechanism for the observation, numerical simulations were performed. Although DME addition resulted in the slight increase of methyl radicals from pyrolysis, the decrease in acetylene and propargyl radicals

Experimental study of the interaction of HO2 radicals with soot surface.

Science.gov (United States)

Bedjanian, Yuri; Lelièvre, Stéphane; Le Bras, Georges

2005-01-21

The reaction of HO2 with toluene and kerosene flame soot was studied over the temperature range 240-350 K and at P = 0.5-5 Torr of helium using a discharge flow reactor coupled to a modulated molecular beam mass spectrometer. A flat-flame burner was used for the preparation and deposition of soot samples from premixed flames of liquid fuels under well controlled and adjustable combustion conditions. The independent of temperature in the range 240-350 K value of gamma = (7.5 +/- 1.5) x 10(-2) (calculated with geometric surface area) was found for the uptake coefficient of HO2 on kerosene and toluene soot. No significant deactivation of soot surface during its reaction with HO2 was observed. Experiments on soot ageing under ambient conditions showed that the reactivity of aged soot is similar to that of freshly prepared soot samples. The results show that the HO2 + soot reaction could be a significant loss process for HOx in the urban atmosphere with a potential impact on photochemical ozone formation. In contrast this process will be negligible in the upper troposphere even in flight corridors.

Fractal-like dimension of nanometer Diesel soot particles

Energy Technology Data Exchange (ETDEWEB)

Skillas, G.; Baltensperger, U. [Paul Scherrer Inst. (PSI), Villigen (Switzerland); Siegmann, K. [Eidgenoessische Technische Hochschule, Zurich (Switzerland)

1997-11-01

Measurements with a low-pressure impactor and a differential mobility analyser were conducted for Diesel soot at various engine loads. By means of these measurements a fractal-like dimension of Diesel soot particles, with diameters ranging from 55 up to 260 nm, was established. (author) 2 figs., 7 refs.

Bidisperse and polydisperse suspension rheology at large solid fraction

Energy Technology Data Exchange (ETDEWEB)

Pednekar, Sidhant [Benjamin Levich Institute and Department of Chemical Engineering, The City College of New York, New York, New York 10031; Chun, Jaehun [Pacific Northwest National Laboratory, Richland, Washington 99352; Morris, Jeffrey F. [Benjamin Levich Institute and Department of Chemical Engineering, The City College of New York, New York, New York 10031

2018-03-01

At the same solid volume fraction, bidisperse and polydisperse suspensions display lower viscosities, and weaker normal stress response, compared to monodisperse suspensions. The reduction of viscosity associated with size distribution can be explained by an increase of the maximum flowable, or jamming, solid fraction. In this work, concentrated or "dense" suspensions are simulated under strong shearing, where thermal motion and repulsive forces are negligible, but we allow for particle contact with a mild frictional interaction with interparticle friction coefficient of 0.2. Aspects of bidisperse suspension rheology are first revisited to establish that the approach reproduces established trends; the study of bidisperse suspensions at size ratios of large to small particle radii (2 to 4) shows that a minimum in the viscosity occurs for zeta slightly above 0.5, where zeta=phi_{large}/phi is the fraction of the total solid volume occupied by the large particles. The simple shear flows of polydisperse suspensions with truncated normal and log normal size distributions, and bidisperse suspensions which are statistically equivalent with these polydisperse cases up to third moment of the size distribution, are simulated and the rheologies are extracted. Prior work shows that such distributions with equivalent low-order moments have similar phi_{m}, and the rheological behaviors of normal, log normal and bidisperse cases are shown to be in close agreement for a wide range of standard deviation in particle size, with standard correlations which are functionally dependent on phi/phi_{m} providing excellent agreement with the rheology found in simulation. The close agreement of both viscosity and normal stress response between bi- and polydisperse suspensions demonstrates the controlling in influence of the maximum packing fraction in noncolloidal suspensions. Microstructural investigations and the stress distribution according to particle size are also presented.

Dynamical study of a polydisperse hard-sphere system

KAUST Repository

Nogawa, Tomoaki; Ito, Nobuyasu; Watanabe, Hiroshi

2010-01-01

We study the interplay between the fluid-crystal transition and the glass transition of elastic sphere system with polydispersity using nonequilibrium molecular dynamics simulations. It is found that the end point of the crystal-fluid transition

Catalytic oxidation of soot over alkaline niobates

International Nuclear Information System (INIS)

Pecchi, G.; Cabrera, B.; Buljan, A.; Delgado, E.J.; Gordon, A.L.; Jimenez, R.

2013-01-01

Highlights: ► No previous reported studies about alkaline niobates as catalysts for soot oxidation. ► NaNbO 3 and KNbO 3 perovskite-type oxides show lower activation energy than other lanthanoid perovskite-type oxides. ► The alkaline niobate does not show deactivation by metal loss. - Abstract: The lack of studies in the current literature about the assessment of alkaline niobates as catalysts for soot oxidation has motivated this research. In this study, the synthesis, characterization and assessment of alkaline metal niobates as catalysts for soot combustion are reported. The solids MNbO 3 (M = Li, Na, K, Rb) are synthesized by a citrate method, calcined at 450 °C, 550 °C, 650 °C, 750 °C, and characterized by AAS, N 2 adsorption, XRD, O 2 -TPD, FTIR and SEM. All the alkaline niobates show catalytic activity for soot combustion, and the activity depends basically on the nature of the alkaline metal and the calcination temperature. The highest catalytic activity, expressed as the temperature at which combustion of carbon black occurs at the maximum rate, is shown by KNbO 3 calcined at 650 °C. At this calcination temperature, the catalytic activity follows an order dependent on the atomic number, namely: KNbO 3 > NaNbO 3 > LiNbO 3 . The RbNbO 3 solid do not follow this trend presumably due to the perovskite structure was not reached. The highest catalytic activity shown by of KNbO 3 , despite the lower apparent activation energy of NaNbO 3 , stress the importance of the metal nature and suggests the hypothesis that K + ions are the active sites for soot combustion. It must be pointed out that alkaline niobate subjected to consecutive soot combustion cycles does not show deactivation by metal loss, due to the stabilization of the alkaline metal inside the perovskite structure.

Colloidal quantum dot photovoltaics: The effect of polydispersity

KAUST Repository

Zhitomirsky, David

2012-02-08

The size-effect tunability of colloidal quantum dots enables facile engineering of the bandgap at the time of nanoparticle synthesis. The dependence of effective bandgap on nanoparticle size also presents a challenge if the size dispersion, hence bandgap variability, is not well-controlled within a given quantum dot solid. The impact of this polydispersity is well-studied in luminescent devices as well as in unipolar electronic transport; however, the requirements on monodispersity have yet to be quantified in photovoltaics. Here we carry out a series of combined experimental and model-based studies aimed at clarifying, and quantifying, the importance of quantum dot monodispersity in photovoltaics. We successfully predict, using a simple model, the dependence of both open-circuit voltage and photoluminescence behavior on the density of small-bandgap (large-diameter) quantum dot inclusions. The model requires inclusion of trap states to explain the experimental data quantitatively. We then explore using this same experimentally tested model the implications of a broadened quantum dot population on device performance. We report that present-day colloidal quantum dot photovoltaic devices with typical inhomogeneous linewidths of 100-150 meV are dominated by surface traps, and it is for this reason that they see marginal benefit from reduction in polydispersity. Upon eliminating surface traps, achieving inhomogeneous broadening of 50 meV or less will lead to device performance that sees very little deleterious impact from polydispersity. © 2012 American Chemical Society.

Molecular mechanics and quantum mechanical modeling of hexane soot structure and interactions with pyrene

Directory of Open Access Journals (Sweden)

Kubicki JD

2000-09-01

Full Text Available Molecular simulations (energy minimizations and molecular dynamics of an n-hexane soot model developed by Smith and co-workers (M. S. Akhter, A. R. Chughtai and D. M. Smith, Appl. Spectrosc., 1985, 39, 143; ref. 1 were performed. The MM+ (N. L. Allinger, J. Am. Chem. Soc., 1977, 395, 157; ref. 2 and COMPASS (H. Sun, J. Phys. Chem., 1998, 102, 7338; ref. 3 force fields were tested for their ability to produce realistic soot nanoparticle structure. The interaction of pyrene with the model soot was simulated. Quantum mechanical calculations on smaller soot fragments were carried out. Starting from an initial 2D structure, energy minimizations are not able to produce the observed layering within soot with either force field. Results of molecular dynamics simulations indicate that the COMPASS force field does a reasonably accurate job of reproducing observations of soot structure. Increasing the system size from a 683 to a 2732 atom soot model does not have a significant effect on predicted structures. Neither does the addition of water molecules surrounding the soot model. Pyrene fits within the soot structure without disrupting the interlayer spacing. Polycyclic aromatic hydrocarbons (PAH, such as pyrene, may strongly partition into soot and have slow desorption kinetics because the PAH-soot bonding is similar to soot–soot interactions. Diffusion of PAH into soot micropores may allow the PAH to be irreversibly adsorbed and sequestered so that they partition slowly back into an aqueous phase causing dis-equilibrium between soil organic matter and porewater.

Numerical Investigation of Soot Formation in Non-premixed Flames

KAUST Repository

Abdelgadir, Ahmed Gamaleldin

2017-01-01

Soot is a carbon particulate formed as a result of the combustion of fossil fuels. Due to the health hazard posed by the carbon particulate, government agencies have applied strict regulations to control soot emissions from road vehicles, airplanes

Measurement of Soot Deposition in Automotive Components Using Neutron Radiography

Energy Technology Data Exchange (ETDEWEB)

Zekveld, David; Liu, Liaohui [AMEC NSS, 700 University Ave, Toronto, Ontario, M5G 1X6 (Canada); UOIT, 2000 Simcoe Street North, Oshawa, Ontario, L1H 7K4 (Canada); Harrison, Andrew; Gill, Spencer; Harvel, Glenn [UOIT, 2000 Simcoe Street North, Oshawa, Ontario, L1H 7K4 (Canada); Chang, Jen-Shih [McMaster University, 1280 Main Street West, Hamilton, Ontario, L8S 4L8 (Canada)

2008-07-01

About 40% of air pollution is generated by vehicles and transportation. The particulate matter (PM) emission significantly impacts human health. Fine particles below 2.5 {mu}m (PM2.5) can enter the lungs and lead to respiratory problems. These particles not only influence human health, but also reduce the capability of many automobile exhaust heat exchanging devices. Neutron radiography is a non-destructive method of analyzing carbonaceous PM. While neutron radiography has been demonstrated for soot measurement in the past, the application has not considered the presence of unburned hydrocarbons, significant amounts of moisture nor examined complex geometrical configurations. The purpose of this work is to study a reliable non-destructive testing methodology using neutron radiography for measurement of soot distribution in automotive components. A soot standard (aluminium target) was designed and manufactured as a calibration tool. The standard is radiographed and used to measure the differences between various soot thickness and compositions. The radiograph images are analyzed to determine a calibration curve based upon the composition of the materials which can then be used for analysis of the automotive components. Experiments are performed using a diesel engine to produce soot deposits on exhaust piping. Soot distribution on exhaust piping is measured using neutron radiography. (authors)

Measurement of Soot Deposition in Automotive Components Using Neutron Radiography

International Nuclear Information System (INIS)

Zekveld, David; Liu, Liaohui; Harrison, Andrew; Gill, Spencer; Harvel, Glenn; Chang, Jen-Shih

2008-01-01

About 40% of air pollution is generated by vehicles and transportation. The particulate matter (PM) emission significantly impacts human health. Fine particles below 2.5 μm (PM2.5) can enter the lungs and lead to respiratory problems. These particles not only influence human health, but also reduce the capability of many automobile exhaust heat exchanging devices. Neutron radiography is a non-destructive method of analyzing carbonaceous PM. While neutron radiography has been demonstrated for soot measurement in the past, the application has not considered the presence of unburned hydrocarbons, significant amounts of moisture nor examined complex geometrical configurations. The purpose of this work is to study a reliable non-destructive testing methodology using neutron radiography for measurement of soot distribution in automotive components. A soot standard (aluminium target) was designed and manufactured as a calibration tool. The standard is radiographed and used to measure the differences between various soot thickness and compositions. The radiograph images are analyzed to determine a calibration curve based upon the composition of the materials which can then be used for analysis of the automotive components. Experiments are performed using a diesel engine to produce soot deposits on exhaust piping. Soot distribution on exhaust piping is measured using neutron radiography. (authors)

Developing a predictive model for the chemical composition of soot nanoparticles

Energy Technology Data Exchange (ETDEWEB)

Violi, Angela [Univ. of Michigan, Ann Arbor, MI (United States); Michelsen, Hope [Sandia National Lab. (SNL-CA), Livermore, CA (United States); Hansen, Nils [Sandia National Lab. (SNL-CA), Livermore, CA (United States); Wilson, Kevin [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)

2017-04-07

In order to provide the scientific foundation to enable technology breakthroughs in transportation fuel, it is important to develop a combustion modeling capability to optimize the operation and design of evolving fuels in advanced engines for transportation applications. The goal of this proposal is to develop a validated predictive model to describe the chemical composition of soot nanoparticles in premixed and diffusion flames. Atomistic studies in conjunction with state-of-the-art experiments are the distinguishing characteristics of this unique interdisciplinary effort. The modeling effort has been conducted at the University of Michigan by Prof. A. Violi. The experimental work has entailed a series of studies using different techniques to analyze gas-phase soot precursor chemistry and soot particle production in premixed and diffusion flames. Measurements have provided spatial distributions of polycyclic aromatic hydrocarbons and other gas-phase species and size and composition of incipient soot nanoparticles for comparison with model results. The experimental team includes Dr. N. Hansen and H. Michelsen at Sandia National Labs' Combustion Research Facility, and Dr. K. Wilson as collaborator at Lawrence Berkeley National Lab's Advanced Light Source. Our results show that the chemical and physical properties of nanoparticles affect the coagulation behavior in soot formation, and our results on an experimentally validated, predictive model for the chemical composition of soot nanoparticles will not only enhance our understanding of soot formation since but will also allow the prediction of particle size distributions under combustion conditions. These results provide a novel description of soot formation based on physical and chemical properties of the particles for use in the next generation of soot models and an enhanced capability for facilitating the design of alternative fuels and the engines they will power.

The pH-dependent adsorption of tributyltin to charcoals and soot

International Nuclear Information System (INIS)

Fang Liping; Borggaard, Ole K.; Marcussen, Helle; Holm, Peter E.; Bruun Hansen, Hans Christian

2010-01-01

Widespread use of tributyltin (TBT) poses a serious environmental problem. Adsorption by black carbon (BC) may strongly affect its behavior. The adsorption of TBT to well characterized soot and two charcoals with specific surface area in the range of 62-111 m 2 g -1 have been investigated with main focus on pH effects. The charcoals but not soot possess acidic functional groups. TBT adsorption reaches maximum at pH 6-7 for charcoals, and at pH > 6 for soot. Soot has between 1.5 and 15 times higher adsorption density (0.09-1.77 μmol m -2 ) than charcoals, but charcoals show up to 17 times higher sorption affinities than soot. TBT adsorption is successfully described by a new pH-dependent dual Langmuir model considering electrostatic and hydrophobic adsorption, and pH effects on TBT speciation and BC surface charge. It is inferred that strong sorption of the TBTOH species to BC may affect TBT toxicity. - Tributyltin adsorption to black carbon increases at increasing pH but charcoal exhibits electrostatic and hydrophobic adsorption, whereas soot only adsorbs hydrophobically.

Soot modeling of counterflow diffusion flames of ethylene-based binary mixture fuels

KAUST Repository

Wang, Yu; Raj, Abhijeet Dhayal; Chung, Suk-Ho

2015-01-01

of ethylene and its binary mixtures with methane, ethane and propane based on the method of moments. The soot model has 36 soot nucleation reactions from 8 PAH molecules including pyrene and larger PAHs. Soot surface growth reactions were based on a modified

A computational study of soot formation in opposed-flow diffusion flame interacting with vortices

KAUST Repository

Selvaraj, Prabhu

2017-01-05

The flame-vortex interaction enables the study of basic phenomena that control the coupling between combustion and turbulence. Employing a gas phase reaction mechanism considering polycyclic aromatic hydrocarbons (PAH), a two dimensional counterflow ethylene-air flame is simulated. A reduced mechanism with PAH pathways that includes until coronene and method of moments with interpolative closure (MOMIC) has been employed to calculate the soot characteristics. Interaction of sooting flame with a prescribed decaying random velocity field is being investigated. Counterflow nonpremixed flames at low strain rate sooting conditions are considered. Effects of vortices are studied on the flame structures and its sensitivity on the soot formation characteristics. As the vortex rolls up the flame, integrated soot volume fraction is found to be larger for the air-side vortex. A detailed analysis on the flame structure and its influence on the formation of soot were carried out. The results indicate that the larger PAH species contributes to the soot formation in the airside perturbation regimes, whereas the soot formation is dominated by the soot transport in fuel-side perturbation.

Effect of Dimethyl Ether Mixing on Soot Size Distribution in Premixed Ethylene Flame

KAUST Repository

Li, Zepeng

2016-01-01

As a byproduct of incomplete combustion, soot attracts increasing attentions as extensive researches exploring serious health and environmental effects from soot particles. Soot emission reduction requires a comprehensive understanding

Implementation of two-equation soot flamelet models for laminar diffusion flames

Energy Technology Data Exchange (ETDEWEB)

Carbonell, D.; Oliva, A.; Perez-Segarra, C.D. [Centre Tecnologic de Transferencia de Calor (CTTC), Universitat Politecnica de Catalunya (UPC), ETSEIAT, Colom 11, E-08222, Terrassa (Barcelona) (Spain)

2009-03-15

The two-equation soot model proposed by Leung et al. [K.M. Leung, R.P. Lindstedt, W.P. Jones, Combust. Flame 87 (1991) 289-305] has been derived in the mixture fraction space. The model has been implemented using both Interactive and Non-Interactive flamelet strategies. An Extended Enthalpy Defect Flamelet Model (E-EDFM) which uses a flamelet library obtained neglecting the soot formation is proposed as a Non-Interactive method. The Lagrangian Flamelet Model (LFM) is used to represent the Interactive models. This model uses direct values of soot mass fraction from flamelet calculations. An Extended version (E-LFM) of this model is also suggested in which soot mass fraction reaction rates are used from flamelet calculations. Results presented in this work show that the E-EDFM predict acceptable results. However, it overpredicts the soot volume fraction due to the inability of this model to couple the soot and gas-phase mechanisms. It has been demonstrated that the LFM is not able to predict accurately the soot volume fraction. On the other hand, the extended version proposed here has been shown to be very accurate. The different flamelet mathematical formulations have been tested and compared using well verified reference calculations obtained solving the set of the Full Transport Equations (FTE) in the physical space. (author)

The pH-dependent adsorption of tributyltin to charcoals and soot

Energy Technology Data Exchange (ETDEWEB)

Fang Liping, E-mail: fang@life.ku.d [Department of Basic Sciences and Environment, Faculty of Life Sciences, University of Copenhagen, Thorvaldsensvej 40, DK-1871 Frederiksberg C (Denmark); Borggaard, Ole K.; Marcussen, Helle; Holm, Peter E.; Bruun Hansen, Hans Christian [Department of Basic Sciences and Environment, Faculty of Life Sciences, University of Copenhagen, Thorvaldsensvej 40, DK-1871 Frederiksberg C (Denmark)

2010-12-15

Widespread use of tributyltin (TBT) poses a serious environmental problem. Adsorption by black carbon (BC) may strongly affect its behavior. The adsorption of TBT to well characterized soot and two charcoals with specific surface area in the range of 62-111 m{sup 2} g{sup -1} have been investigated with main focus on pH effects. The charcoals but not soot possess acidic functional groups. TBT adsorption reaches maximum at pH 6-7 for charcoals, and at pH > 6 for soot. Soot has between 1.5 and 15 times higher adsorption density (0.09-1.77 {mu}mol m{sup -2}) than charcoals, but charcoals show up to 17 times higher sorption affinities than soot. TBT adsorption is successfully described by a new pH-dependent dual Langmuir model considering electrostatic and hydrophobic adsorption, and pH effects on TBT speciation and BC surface charge. It is inferred that strong sorption of the TBTOH species to BC may affect TBT toxicity. - Tributyltin adsorption to black carbon increases at increasing pH but charcoal exhibits electrostatic and hydrophobic adsorption, whereas soot only adsorbs hydrophobically.

Aggregated particles caused by instrument artifact

Directory of Open Access Journals (Sweden)

A. M. Pierce

2018-04-01

Full Text Available Previous studies have indicated that superaggregates, clusters of aggregates of soot primary particles, can be formed in large-scale turbulent fires. Due to lower effective densities, higher porosity, and lower aerodynamic diameters, superaggregates may pass through inlets designed to remove particles  <  2.5 µm in aerodynamic diameter (PM2.5. Ambient particulate matter samples were collected at Peavine Peak, NV, USA (2515 m northwest of Reno, NV, USA from June to November 2014. The Teledyne Advanced Pollution Instrumentation (TAPI 602 BetaPlus particulate monitor was used to collect PM2.5 on two filter types. During this time, aggregated particles  >  2.5 µm in aerodynamic diameter were collected on 36 out of 158 sample days. On preliminary analysis, it was thought that these aggregated particles were superaggregates, depositing past PM10 (particles  <  10 µm in aerodynamic diameter pre-impactors and PM2.5 cyclones. However, further analysis revealed that these aggregated particles were dissimilar to superaggregates observed in previous studies, both in morphology and in elemental composition. To determine if the aggregated particles were superaggregates or an instrument artifact, samples were investigated for the presence of certain elements, the occurrence of fires, high relative humidity and wind speeds, as well as the use of generators on site. Samples with aggregated particles, referred to as aggregates, were analyzed using a scanning electron microscope for size and shape and energy dispersive X-ray spectroscopy was used for elemental analysis. It was determined, based on the high amounts of aluminum present in the aggregate samples, that a sampling artifact associated with the sample inlet and prolonged, high wind events was the probable reason for the observed aggregates.

Acoustic waves in polydispersed bubbly liquids

International Nuclear Information System (INIS)

Gubaidullin, D A; Gubaidullina, D D; Fedorov, Yu V

2014-01-01

The propagation of acoustic waves in polydispersed mixtures of liquid with two sorts of gas bubbles each of which has its own bubble size distribution function is studied. The system of the differential equations of the perturbed motion of a mixture is presented, the dispersion relation is obtained. Equilibrium speed of sound, low-frequency and high-frequency asymptotes of the attenuation coefficient are found. Comparison of the developed theory with known experimental data is presented

Acoustic waves in polydispersed bubbly liquids

Science.gov (United States)

Gubaidullin, D. A.; Gubaidullina, D. D.; Fedorov, Yu V.

2014-11-01

The propagation of acoustic waves in polydispersed mixtures of liquid with two sorts of gas bubbles each of which has its own bubble size distribution function is studied. The system of the differential equations of the perturbed motion of a mixture is presented, the dispersion relation is obtained. Equilibrium speed of sound, low-frequency and high-frequency asymptotes of the attenuation coefficient are found. Comparison of the developed theory with known experimental data is presented.

Spectral Signature of Radiative Forcing by East Asian Dust-Soot Mixture

Science.gov (United States)

Zhu, A.; Ramanathan, V.

2007-12-01

The Pacific Dust Experiment (PACDEX) provides the first detailed sampling of dust-soot mixtures from the western Pacific to the eastern Pacific Ocean. The data includes down and up spectral irradiance, mixing state of dust and soot, and other aerosol properties. This study attempts to simulate the radiative forcing by dust-soot mixtures during the experimental period. The MODTRAN band model was employed to investigate the spectral signatures of solar irradiance change induced by aerosols at moderate spectral resolutions. For the short wave band (300-1100nm) used in this study, the reduction of downward irradiance at surface by aerosols greatly enhances with increasing wavelength in the UV band (300-400nm), reaches a maximum in the blue band, then gradually decreases toward the red band. In the near-IR band (700-1100nm), irradiance reduction by aerosols shows great fluctuations in the band with center wavelength at around 940nm, 820nm, 720nm, 760nm, 690nm, where the aerosol effect is overwhelmed by the water vapor and O2 absorptions. The spectral pattern of irradiance reduction varies for different aerosol species. The maximum reduction lies at around 450nm for soot, and shifting to about 490nm for East Asian mineral dust. It's worth noting that although soot aerosols reduce more irradiance than East Asian dust in the UV and blue band, the impact of dust to the irradiance exceeds that by soot at the longer wavelength band (i.e. around 550nm). The reduction of irradiance by East Asian dust (soot) in the UV band, visible band, and near-IR accounts for about 6% (10%), 56% (64%), and 38% (26%) of total irradiance reduction. As large amount of soot aerosols are involved during the long range transport of East Asian dust, the optical properties of dust aerosols are modified with different mixing state with soot, the spectral pattern of the irradiance reduction will be changed. The study of aerosol forcing at moderate spectral resolutions has the potential application for

Development and implementation of Intelligent Soot Blowing Optimization System for TNB Janamanjung

Directory of Open Access Journals (Sweden)

Sundaram Taneshwaren

2017-01-01

Full Text Available With an ever increasing demand for energy, Malaysia has become a nation that thrives on solid power generation sector to meet the energy demand and supply market. In a coal fired power plant, soot blowing operation is commonly used as a cleaning mechanism inside the boiler. There are many types of sequence available for this soot blowing operation. Hence, there is no efficient ways in utilizing the soot blowing operation to enhance the efficiency of boiler. Soot blowing optimization requires specific set of data preparation and simulation in order to achieve the best modal. Computational Fluid Dynamics (CFD is used to model a 700MW super-critical boiler, whereby parameters with effect to soot blowing operation is studied. Two different boiler condition is studied to analyze parameters in a clean and faulty boiler. Artificial Neural Network (ANN is used to train neural network modal with back propagation method to determine the best modal that will be used to predict soot blowing operation. Combination of neural network different number of neurons, hidden layers, training algorithm, and training functions is trained to find the modal with lowest error. By improving soot blowing sequence, efficiency of boiler can be improved by providing best parameter and model. This model is then used as a reference for advisory tool whereby a Neural Network Predictive Tool is suggested to the station to predict the soot blowing operation that occurs.

Effect of NO2 and water on the catalytic oxidation of soot

DEFF Research Database (Denmark)

Christensen, Jakob Munkholt; Grunwaldt, Jan-Dierk; Jensen, Anker Degn

2017-01-01

The influence of adding NO2 to 10 vol% O2/N2 on non-catalytic soot oxidation and soot oxidation in intimate or loose contact with a catalyst has been investigated. In non-catalytic soot oxidation the oxidation rate is increased significantly at lower temperatures by NO2. For soot oxidation in tig...... exhibited a volcano-curve dependence on the heat of oxygen chemisorption, and among the tested pure metals and oxides Cr2O3 was the most active catalyst. Further improvements were achieved with a FeaCrbOx binary oxide catalyst....

Investigations of the long-term effects of LII on soot and bath gas

KAUST Repository

Cenker, Emre

2017-08-24

A combination of high-repetition rate imaging, laser extinction measurements, two-colour soot pyrometry imaging, and high-resolution transmission electron microscopy of thermophoretically sampled soot is used to investigate the long-term and permanent effects of rapid heating of in-flame soot during laser-induced incandescence (LII). Experiments are carried out on a laminar non-premixed co-annular ethylene/air flame with various laser fluences. The high-repetition rate images clearly show that the heated and the neighbouring laser-border zones undergo a permanent transformation after the laser pulse, and advect vertically with the flow while the permanent marking is preserved. The soot volume fraction at the heated zone reduces due to the sublimation of soot and the subsequent enhanced oxidation. At the laser-border zones, however, optical thickness increases that may be due to thermophoretic forces drawing hot particles towards relatively cooler zones and the rapid compression of the bath gas induced by the pressure waves created by the expansion of the desorbed carbon clusters. Additionally sublimed carbon clusters can condense onto existing particles and contribute to increase of the optical thickness. Time-resolved two-colour pyrometry imaging show that the increased temperature of soot both in the heated and neighbouring laser-border zones persists for several milliseconds. This can be associated to the increase in the bath-gas temperature, and a change in the wavelength-dependent emissivity of soot particles induced by the thermal annealing of soot. Ex-situ analysis show that the lattice structure of the soot sampled at the laser-border zones tend to change and soot becomes more graphitic. This may be attributed to thermal annealing induced by elevated temperature.

Soot reduction under DC electric fields in counterflow non-premixed laminar ethylene flames

KAUST Repository

Park, Daegeun

2014-04-23

The effects of DC electric fields on non-premixed ethylene flames in a counterflow burner were studied experimentally with a focus on the reduction of soot particles. The experiment was conducted by connecting a high voltage terminal and a ground terminal to a lower (fuel) and upper (oxidizer) nozzle, respectively. We applied direct current (DC) potentials in a range of -5 kV < Vdc < 5 kV. Uniform electric fields were then generated in the gap between the two nozzles. The experimental conditions were selected to cover both soot formation (SF) and soot formation oxidation (SFO) flames. The flames subjected to the negative electric fields moved toward the fuel nozzle because of an ionic wind due to the Lorentz force acting on the positive ions in the flames. In addition, the yellow luminosity significantly decreased, indicating changes in the sooting characteristics. To analyze the sooting characteristics under the electric fields, planar laser induced incandescence (PLII) and fluorescence (PLIF) techniques were used to visualize the soot, polycyclic aromatic hydrocarbons (PAHs), and OH radicals. The sooting limits in terms of the fuel and oxygen mole fractions were measured. No substantial soot formation due to the effects of the DC electric fields for the tested range of voltages and reactant mole fractions could be identified. The detailed flame behaviors and sooting characteristics under the DC electric fields are discussed. Copyright © Taylor & Francis Group, LLC.

Source identification of individual soot agglomerates in Arctic air by transmission electron microscopy

Science.gov (United States)

Weinbruch, S.; Benker, N.; Kandler, K.; Schütze, K.; Kling, K.; Berlinger, B.; Thomassen, Y.; Drotikova, T.; Kallenborn, R.

2018-01-01

Individual soot agglomerates collected at four different locations on the Arctic archipelago Svalbard (Norway) were characterised by transmission electron microscopy and energy-dispersive X-ray microanalysis. For source identification of the ambient soot agglomerates, samples from different local sources (coal burning power plants in Longyearbyen and Barentsburg, diesel and oil burning for power generation in Sveagruva and Ny Ålesund, cruise ship) as well as from other sources which may contribute to Arctic soot concentrations (biomass burning, aircraft emissions, diesel engines) were investigated. Diameter and graphene sheet separation distance of soot primary particles were found to be highly variable within each source and are not suited for source identification. In contrast, concentrations of the minor elements Si, P, K, Ca and Fe showed significant differences which can be used for source attribution. The presence/absence of externally mixed particle groups (fly ashes, tar balls, mercury particles) gives additional hints about the soot sources. Biomass/wood burning, ship emissions and coal burning in Barentsburg can be excluded as major source for ambient soot at Svalbard. The coal power plant in Longyearbyen is most likely a major source of soot in the settlement of Longyearbyen but does not contribute significantly to soot collected at the Global Atmosphere Watch station Zeppelin Mountain near Ny Ålesund. The most probable soot sources at Svalbard are aircraft emissions and diesel exhaust as well as long range transport of coal burning emissions.

Role of soot in the transport of chlorine in hydrocarbon-air diffusion flames

International Nuclear Information System (INIS)

Venkatesh, S.; Saito, K.; Stencel, J.M.; Majidi, V.; Owens, M.

1991-01-01

Soot is an inevitable product of incomplete combustion in many practical combustion systems such as automobiles, incinerators and furnaces. Recent studies on chlorinated hydrocarbon combustion have shown that soot and other praticulates (eg. fly ash) play an important role in secondary reactions leading to the formation of chlorine substituted polyaromatic hydrocarbons (PAHs). In order to attain very high destruction efficiencies the fundamental chemical and physical processes that are associated with combustion, and post-combustion cleanup must be well understood. In order to understand the effect of chlorine on the soot formed in a combustion system, fundamental studies using a coflow laminar hydrocarbon-air diffusion flame have been carried out. Phenomenological studies have revealed the effect of chlorine on the visible structure of the flame. Soot inception activation energies were estimated for methane, ethane and ethylene diffusion flames for the case of with and without chlorine addition. No significant difference in the activation energy was estimated for either case. The effect of chlorine on the soot escape rate of an acetylene diffusion flame was estimated. The soot formed in these diffusion flames was analyzed for chlorine using scanning electron microscopy with energy dispersive spectroscopy (SEM/EDS) and by laser induced plasma spectroscopy (LIPS). REsults from these techniques indicate the presence of chlorine in the soot formed. In this paper a chemical scheme to explain the chlorine found in the soot is proposed based on known theories of soot formation

New Nanotech from an Ancient Material: Chemistry Demonstrations Involving Carbon-Based Soot

Science.gov (United States)

Campbell, Dean J.; Andrews, Mark J.; Stevenson, Keith J.

2012-01-01

Carbon soot has been known since antiquity, but has recently been finding new uses as a robust, inexpensive nanomaterial. This paper describes the superhydrophobic properties of carbon soot films prepared by combustion of candle wax or propane gas and introduces some of the optical absorption and fluorescence properties of carbon soot particles.…

The Ice Nucleation Activity of Surface Modified Soot

Science.gov (United States)

Häusler, Thomas; Witek, Lorenz; Felgitsch, Laura; Hitzenberger, Regina; Grothe, Hinrich

2017-04-01

The ice nucleation efficiency of many important atmospheric particles remains poorly understood. Since soot is ubiquitous in the Earth's troposphere, they might have the potential to significantly impact the Earth's climate (Finlayson-Pitts and Pitts, 2000; Seinfeld and Pandis, 1998). Here we present the ice nucleation activity (INA) in immersion freezing mode of different types of soot. Therefor a CAST (combustion aerosol standard) generator was used to produce different kinds of soot samples. The CAST generator combusts a propane-air-mixture and deposits thereby produced soot on a polyvinyl fluoride filter. By varying the propane to air ratio, the amount of organic portion of the soot can be varied from black carbon (BC) with no organic content to brown carbon (BrC) with high organic content. To investigate the impact of functional sites of ice nuclei (IN), the soot samples were exposed to NO2 gas for a certain amount of time (30 to 360 minutes) to chemically modify the surface. Immersion freezing experiments were carried out in a unique reaction gadget. In this device a water-in-oil suspension (with the soot suspended in the aqueous phase) was cooled till the freezing point and was observed through a microscope (Pummer et al., 2012; Zolles et al., 2015) It was found that neither modified nor unmodified BC shows INA. On the contrary, unmodified BrC shows an INA at -32˚ C, which can be increased up to -20˚ C. The INA of BrC depends on the duration of NO2- exposure. To clarify the characteristics of the surface modifications, surface sensitive analysis like infrared spectroscopy and X-ray photoelectron spectroscopy were carried out. Finlayson-Pitts, B. J. and Pitts, J. N. J.: Chemistry of the Upper and Lower Atmosphere, Elsevier, New York, 2000. Pummer, B. G., Bauer, H., Bernardi, J., Bleicher, S., and Grothe, H.: Suspendable macromolecules are responsible for ice nucleation activity of birch and conifer pollen, Atmos Chem Phys, 12, 2541-2550, 2012. Seinfeld, J

Comparative Study of Different Methods for Soot Sensing and Filter Monitoring in Diesel Exhausts

Science.gov (United States)

Feulner, Markus; Hagen, Gunter; Hottner, Kathrin; Redel, Sabrina; Müller, Andreas; Moos, Ralf

2017-01-01

Due to increasingly tighter emission limits for diesel and gasoline engines, especially concerning particulate matter emissions, particulate filters are becoming indispensable devices for exhaust gas after treatment. Thereby, for an efficient engine and filter control strategy and a cost-efficient filter design, reliable technologies to determine the soot load of the filters and to measure particulate matter concentrations in the exhaust gas during vehicle operation are highly needed. In this study, different approaches for soot sensing are compared. Measurements were conducted on a dynamometer diesel engine test bench with a diesel particulate filter (DPF). The DPF was monitored by a relatively new microwave-based approach. Simultaneously, a resistive type soot sensor and a Pegasor soot sensing device as a reference system measured the soot concentration exhaust upstream of the DPF. By changing engine parameters, different engine out soot emission rates were set. It was found that the microwave-based signal may not only indicate directly the filter loading, but by a time derivative, the engine out soot emission rate can be deduced. Furthermore, by integrating the measured particulate mass in the exhaust, the soot load of the filter can be determined. In summary, all systems coincide well within certain boundaries and the filter itself can act as a soot sensor. PMID:28218700

Comparative Study of Different Methods for Soot Sensing and Filter Monitoring in Diesel Exhausts.

Science.gov (United States)

Feulner, Markus; Hagen, Gunter; Hottner, Kathrin; Redel, Sabrina; Müller, Andreas; Moos, Ralf

2017-02-18

Due to increasingly tighter emission limits for diesel and gasoline engines, especially concerning particulate matter emissions, particulate filters are becoming indispensable devices for exhaust gas after treatment. Thereby, for an efficient engine and filter control strategy and a cost-efficient filter design, reliable technologies to determine the soot load of the filters and to measure particulate matter concentrations in the exhaust gas during vehicle operation are highly needed. In this study, different approaches for soot sensing are compared. Measurements were conducted on a dynamometer diesel engine test bench with a diesel particulate filter (DPF). The DPF was monitored by a relatively new microwave-based approach. Simultaneously, a resistive type soot sensor and a Pegasor soot sensing device as a reference system measured the soot concentration exhaust upstream of the DPF. By changing engine parameters, different engine out soot emission rates were set. It was found that the microwave-based signal may not only indicate directly the filter loading, but by a time derivative, the engine out soot emission rate can be deduced. Furthermore, by integrating the measured particulate mass in the exhaust, the soot load of the filter can be determined. In summary, all systems coincide well within certain boundaries and the filter itself can act as a soot sensor.

Comparative Study of Different Methods for Soot Sensing and Filter Monitoring in Diesel Exhausts

Directory of Open Access Journals (Sweden)

Markus Feulner

2017-02-01

Full Text Available Due to increasingly tighter emission limits for diesel and gasoline engines, especially concerning particulate matter emissions, particulate filters are becoming indispensable devices for exhaust gas after treatment. Thereby, for an efficient engine and filter control strategy and a cost-efficient filter design, reliable technologies to determine the soot load of the filters and to measure particulate matter concentrations in the exhaust gas during vehicle operation are highly needed. In this study, different approaches for soot sensing are compared. Measurements were conducted on a dynamometer diesel engine test bench with a diesel particulate filter (DPF. The DPF was monitored by a relatively new microwave-based approach. Simultaneously, a resistive type soot sensor and a Pegasor soot sensing device as a reference system measured the soot concentration exhaust upstream of the DPF. By changing engine parameters, different engine out soot emission rates were set. It was found that the microwave-based signal may not only indicate directly the filter loading, but by a time derivative, the engine out soot emission rate can be deduced. Furthermore, by integrating the measured particulate mass in the exhaust, the soot load of the filter can be determined. In summary, all systems coincide well within certain boundaries and the filter itself can act as a soot sensor.

Asymptotic analysis soot model and experiment for a directed injection engine

Science.gov (United States)

Liu, Yongfeng; Pei, Pucheng; Xiong, Qinghui; Lu, Yong

2012-09-01

The existing soot models are either too complex and can not be applied to the internal combustion engine, or too simple to make calculation errors. Exploring the soot model becomes the pursuit of the goal of many researchers within the error range in the current computer speed. On the basis of the latest experimental results, TP (temperature phases) model is presented as a new soot model to carry out optimization calculation for a high-pressure common rail diesel engine. Temperature and excess air factor are the most important two parameters in this model. When zone temperature T0.6, only the soot precursors—polycyclic aromatic hydrocarbons(PAH) is created and there is no soot emission. When zone temperature T ⩾ 1 500 K and excess air factor Φinjection time, variation of rail pressure and variation of speed among TP models. The experimental results indicate that the TP model can carry out optimization and computational fluid dynamics can be a tool to calculate for a high-pressure common rail directed injection diesel engine. The TP model result is closer than the use of the original KIVA-3V results of soot model accuracy by about 50% and TP model gives a new method for engine researchers.

Empirical soot formation and oxidation model

Directory of Open Access Journals (Sweden)

Boussouara Karima

2009-01-01

Full Text Available Modelling internal combustion engines can be made following different approaches, depending on the type of problem to be simulated. A diesel combustion model has been developed and implemented in a full cycle simulation of a combustion, model accounts for transient fuel spray evolution, fuel-air mixing, ignition, combustion, and soot pollutant formation. The models of turbulent combustion of diffusion flame, apply to diffusion flames, which one meets in industry, typically in the diesel engines particulate emission represents one of the most deleterious pollutants generated during diesel combustion. Stringent standards on particulate emission along with specific emphasis on size of emitted particulates have resulted in increased interest in fundamental understanding of the mechanisms of soot particulate formation and oxidation in internal combustion engines. A phenomenological numerical model which can predict the particle size distribution of the soot emitted will be very useful in explaining the above observed results and will also be of use to develop better particulate control techniques. A diesel engine chosen for simulation is a version of the Caterpillar 3406. We are interested in employing a standard finite-volume computational fluid dynamics code, KIVA3V-RELEASE2.

A computational study of ethylene–air sooting flames: Effects of large polycyclic aromatic hydrocarbons

KAUST Repository

Selvaraj, Prabhu

2015-11-05

An updated reduced gas-phase kinetic mechanism was developed and integrated with aerosol models to predict soot formation characteristics in ethylene nonpremixed and premixed flames. A primary objective is to investigate the sensitivity of the soot formation to various chemical pathways for large polycyclic aromatic hydrocarbons (PAH). The gas-phase chemical mechanism adopted the KAUST-Aramco PAH Mech 1.0, which utilized the AramcoMech 1.3 for gas-phase reactions validated for up to C2 fuels. In addition, PAH species up to coronene (C24H12 or A7) were included to describe the detailed formation pathways of soot precursors. In this study, the detailed chemical mechanism was reduced from 397 to 99 species using directed relation graph with expert knowledge (DRG-X) and sensitivity analysis. The method of moments with interpolative closure (MOMIC) was employed for the soot aerosol model. Counterflow nonpremixed flames at low strain rate sooting conditions were considered, for which the sensitivity of soot formation characteristics to different nucleation pathways were investigated. Premixed flame experiment data at different equivalence ratios were also used for validation. The findings show that higher PAH concentrations result in a higher soot nucleation rate, and that the total soot volume and average size of the particles are predicted in good agreement with experimental results. Subsequently, the effects of different pathways, with respect to pyrene- or coronene-based nucleation models, on the net soot formation rate were analyzed. It was found that the nucleation processes (i.e., soot inception) are sensitive to the choice of PAH precursors, and consideration of higher PAH species beyond pyrene is critical for accurate prediction of the overall soot formation.

Numerical modeling of soot formation in a turbulent C2H4/air diffusion flame

Directory of Open Access Journals (Sweden)

Manedhar Reddy Busupally

2016-06-01

Full Text Available Soot formation in a lifted C2H4-Air turbulent diffusion flame is studied using two different paths for soot nucleation and oxidation; by a 2D axisymmetric RANS simulation using ANSYS FLUENT 15.0. The turbulence-chemistry interactions are modeled using two different approaches: steady laminar flamelet approach and flamelet-generated manifold. Chemical mechanism is represented by POLIMI to study the effect of species concentration on soot formation. P1 approximation is employed to approximate the radiative transfer equation into truncated series expansion in spherical harmonics while the weighted sum of gray gases is invoked to model the absorption coefficient while the soot model accounts for nucleation, coagulation, surface growth, and oxidation. The first route for nucleation considers acetylene concentration as a linear function of soot nucleation rate, whereas the second route considers two and three ring aromatic species as function of nucleation rate. Equilibrium-based and instantaneous approach has been used to estimate the OH concentration for soot oxidation. Lee and Fenimore-Jones soot oxidation models are studied to shed light on the effect of OH on soot oxidation. Moreover, the soot-radiation interactions are also included in terms of absorption coefficient of soot. Furthermore, the soot-turbulence interactions have been invoked using a temperature/mixture fraction-based single variable PDF. Both the turbulence-chemistry interaction models are able to accurately predict the flame liftoff height, and for accurate prediction of flame length, radiative heat loss should be accounted in an accurate way. The soot-turbulence interactions are found sensitive to the PDF used in present study.

Conductometric Sensor for Soot Mass Flow Detection in Exhausts of Internal Combustion Engines.

Science.gov (United States)

Feulner, Markus; Hagen, Gunter; Müller, Andreas; Schott, Andreas; Zöllner, Christian; Brüggemann, Dieter; Moos, Ralf

2015-11-13

Soot sensors are required for on-board diagnostics (OBD) of automotive diesel particulate filters (DPF) to detect filter failures. Widely used for this purpose are conductometric sensors, measuring an electrical current or resistance between two electrodes. Soot particles deposit on the electrodes, which leads to an increase in current or decrease in resistance. If installed upstream of a DPF, the "engine-out" soot emissions can also be determined directly by soot sensors. Sensors were characterized in diesel engine real exhausts under varying operation conditions and with two different kinds of diesel fuel. The sensor signal was correlated to the actual soot mass and particle number, measured with an SMPS. Sensor data and soot analytics (SMPS) agreed very well, an impressing linear correlation in a double logarithmic representation was found. This behavior was even independent of the used engine settings or of the biodiesel content.

Conductometric Sensor for Soot Mass Flow Detection in Exhausts of Internal Combustion Engines

Science.gov (United States)

Feulner, Markus; Hagen, Gunter; Müller, Andreas; Schott, Andreas; Zöllner, Christian; Brüggemann, Dieter; Moos, Ralf

2015-01-01

Soot sensors are required for on-board diagnostics (OBD) of automotive diesel particulate filters (DPF) to detect filter failures. Widely used for this purpose are conductometric sensors, measuring an electrical current or resistance between two electrodes. Soot particles deposit on the electrodes, which leads to an increase in current or decrease in resistance. If installed upstream of a DPF, the “engine-out” soot emissions can also be determined directly by soot sensors. Sensors were characterized in diesel engine real exhausts under varying operation conditions and with two different kinds of diesel fuel. The sensor signal was correlated to the actual soot mass and particle number, measured with an SMPS. Sensor data and soot analytics (SMPS) agreed very well, an impressing linear correlation in a double logarithmic representation was found. This behavior was even independent of the used engine settings or of the biodiesel content. PMID:26580621

Conductometric Sensor for Soot Mass Flow Detection in Exhausts of Internal Combustion Engines

Directory of Open Access Journals (Sweden)

Markus Feulner

2015-11-01

Full Text Available Soot sensors are required for on-board diagnostics (OBD of automotive diesel particulate filters (DPF to detect filter failures. Widely used for this purpose are conductometric sensors, measuring an electrical current or resistance between two electrodes. Soot particles deposit on the electrodes, which leads to an increase in current or decrease in resistance. If installed upstream of a DPF, the “engine-out” soot emissions can also be determined directly by soot sensors. Sensors were characterized in diesel engine real exhausts under varying operation conditions and with two different kinds of diesel fuel. The sensor signal was correlated to the actual soot mass and particle number, measured with an SMPS. Sensor data and soot analytics (SMPS agreed very well, an impressing linear correlation in a double logarithmic representation was found. This behavior was even independent of the used engine settings or of the biodiesel content.

Understanding Combustion and Soot Formation in Diesel Engines

Science.gov (United States)

2016-09-09

distributions of PLII signals help understand the soot distributions within diesel/ biodiesel flames. In addition, planar laser-induced Figure 1. Transported ...Prescribed by ANSI Std. Z39.18 Page 1 of 1FORM SF 298 9/14/2016https://livelink.ebs.afrl.af.mil/livelink/llisapi.dll This project investigated biodiesel ...emissions testing. 1 FINAL REPORT Project title: Understanding combustion and soot formation in biodiesel fuelled diesel engines Lead Institute and

Segregative phase separation in aqueous mixtures of polydisperse biopolymers

NARCIS (Netherlands)

Edelman, M.W.

2003-01-01

Keywords: biopolymer, gelatine, dextran, PEO, phase separation, polydispersity, molar mass distribution, SEC-MALLS, CSLM The temperature-composition phase diagram of aqueous solutions of gelatine and dextran, which show liquid/liquid phase segregation, were explored at temperatures above the

Impacts of fuel formulation and engine operating parameters on the nanostructure and reactivity of diesel soot

Science.gov (United States)

Yehliu, Kuen

This study focuses on the impacts of fuel formulations on the reactivity and nanostructure of diesel soot. A 2.5L, 4-cylinder, turbocharged, common rail, direct injection light-duty diesel engine was used in generating soot samples. The impacts of engine operating modes and the start of combustion on soot reactivity were investigated first. Based on preliminary investigations, a test condition of 2400 rpm and 64 Nm, with single and split injection strategies, was chosen for studying the impacts of fuel formulation on the characteristics of diesel soot. Three test fuels were used: an ultra low sulfur diesel fuel (BP15), a pure soybean methyl-ester (B100), and a synthetic Fischer-Tropsch fuel (FT) produced in a gas-to-liquid process. The start of injection (SOI) and fuel rail pressures were adjusted such that the three test fuels have similar combustion phasing, thereby facilitating comparisons between soots from the different fuels. Soot reactivity was investigated by thermogravimetric analysis (TGA). According to TGA, B100 soot exhibits the fastest oxidation on a mass basis followed by BP15 and FT derived soots in order of apparent rate constant. X-ray photoelectron spectroscopy (XPS) indicates no relation between the surface oxygen content and the soot reactivity. Crystalline information for the soot samples was obtained using X-ray diffraction (XRD). The basal plane diameter obtained from XRD was inversely related to the apparent rate constants for soot oxidation. For comparison, high resolution transmission electron microscopy (HRTEM) provided images of the graphene layers. Quantitative image analysis proceeded by a custom algorithm. B100 derived soot possessed the shortest mean fringe length and greatest mean fringe tortuosity. This suggests soot (nano)structural disorder correlates with a faster oxidation rate. Such results are in agreement with the X-ray analysis, as the observed fringe length is a measure of basal plane diameter. Moreover the relation

Effects of Large Polycyclic Aromatic Hydrocarbons on the Soot Formation in Ethylene-Air Nonpremixed Flames

KAUST Repository

Prabhu, S.; Arias, P.G.; Wang, Y.; Gao, Y.; Park, S.; Im, Hong G.; Sarathy, Mani; Chung, Suk-Ho; Lu, T.

2015-01-01

This study presents updated comprehensive gas-phase kinetic mechanism and aerosol models to predict soot formation characteristics in ethylene-air nonpremixed flames. A main objective is to investigate the sensitivity of the soot formation rate to various chemical pathways for large polycyclic aromatic hydrocarbons (PAH). In this study, the detailed chemical mechanism was reduced from 397 to 99 species using directed relation graph (DRG) and sensitivity analysis. The method of moments with interpolative closure (MOMIC) was employed for the soot aerosol model. Counterflow nonpremixed flames of pure ethylene at low strain rate sooting conditions are considered, for which the sensitivity of soot formation characteristics with respect to hetrogeneous nucleation is investigated. Results show that higher PAH concentrations result in higher soot nucleation rate, and that the average size of the particles are in good agreement with experimental results. It is found that the nucleation processes (i.e., soot inception) from higher PAH precursors, coronene in particular, is critical for accurate prediction of the overall soot formation.

Effects of Large Polycyclic Aromatic Hydrocarbons on the Soot Formation in Ethylene-Air Nonpremixed Flames

KAUST Repository

Prabhu, S.

2015-03-30

This study presents updated comprehensive gas-phase kinetic mechanism and aerosol models to predict soot formation characteristics in ethylene-air nonpremixed flames. A main objective is to investigate the sensitivity of the soot formation rate to various chemical pathways for large polycyclic aromatic hydrocarbons (PAH). In this study, the detailed chemical mechanism was reduced from 397 to 99 species using directed relation graph (DRG) and sensitivity analysis. The method of moments with interpolative closure (MOMIC) was employed for the soot aerosol model. Counterflow nonpremixed flames of pure ethylene at low strain rate sooting conditions are considered, for which the sensitivity of soot formation characteristics with respect to hetrogeneous nucleation is investigated. Results show that higher PAH concentrations result in higher soot nucleation rate, and that the average size of the particles are in good agreement with experimental results. It is found that the nucleation processes (i.e., soot inception) from higher PAH precursors, coronene in particular, is critical for accurate prediction of the overall soot formation.

Laser-induced incandescence: Towards quantitative soot volume fraction measurements

Energy Technology Data Exchange (ETDEWEB)

Tzannis, A P; Wienbeucker, F; Beaud, P; Frey, H -M; Gerber, T; Mischler, B; Radi, P P [Paul Scherrer Inst. (PSI), Villigen (Switzerland)

1999-08-01

Laser-Induced Incandescence has recently emerged as a versatile tool for measuring soot volume fraction in a wide range of combustion systems. In this work we investigate the essential features of the method. LII is based on the acquisition of the incandescence of soot when heated through a high power laser pulse. Initial experiments have been performed on a model laboratory flame. The behaviour of the LII signal is studied experimentally. By applying numerical calculations we investigate the possibility to obtain two-dimensional soot volume fraction distributions. For this purpose a combination of LII with other techniques is required. This part is discussed in some extent and the future work is outlined. (author) 4 figs., 3 refs.

Variation of diesel soot characteristics by different types and blends of biodiesel in a laboratory combustion chamber

Energy Technology Data Exchange (ETDEWEB)

Omidvarborna, Hamid; Kumar, Ashok [Department of Civil Engineering, The University of Toledo, Toledo, OH (United States); Kim, Dong-Shik, E-mail: dong.kim@utoledo.edu [Department of Chemical and Environmental Engineering, The University of Toledo, Toledo, OH (United States)

2016-02-15

Very little information is available on the physical and chemical properties of soot particles produced in the combustion of different types and blends of biodiesel fuels. A variety of feedstock can be used to produce biodiesel, and it is necessary to better understand the effects of feedstock-specific characteristics on soot particle emissions. Characteristics of soot particles, collected from a laboratory combustion chamber, are investigated from the blends of ultra-low sulfur diesel (ULSD) and biodiesel with various proportions. Biodiesel samples were derived from three different feedstocks, soybean methyl ester (SME), tallow oil (TO), and waste cooking oil (WCO). Experimental results showed a significant reduction in soot particle emissions when using biodiesel compared with ULSD. For the pure biodiesel, no soot particles were observed from the combustion regardless of their feedstock origins. The overall morphology of soot particles showed that the average diameter of ULSD soot particles is greater than the average soot particles from the biodiesel blends. Transmission electron microscopy (TEM) images of oxidized soot particles are presented to investigate how the addition of biodiesel fuels may affect structures of soot particles. In addition, inductively coupled plasma mass spectrometry (ICP-MS), Fourier transform infrared spectroscopy (FTIR), and thermogravimetric analysis (TGA) were conducted for characterization of soot particles. Unsaturated methyl esters and high oxygen content of biodiesel are thought to be the major factors that help reduce the formation of soot particles in a laboratory combustion chamber. - Highlights: • The unsaturation of biodiesel fuel was correlated with soot characteristics. • Average diameters of biodiesel soot were smaller than that of ULSD. • Eight elements were detected as the marker metals in biodiesel soot particles. • As the degree of unsaturation increased, the oxygen content in FAMEs increased. • Biodiesel

Transverse gradient diffusion in a polydisperse dilute suspension of magnetic spheres during sedimentation

International Nuclear Information System (INIS)

Cunha, F R; Couto, H L G

2008-01-01

In this work we investigate the pair interaction of magnetic particles in a dilute polydisperse sedimenting suspension. The suspension is composed of magnetic spherical forms of different radii and densities immersed in a Newtonian fluid, settling due to the gravity. When in close contact, the particles may exert on each other a magnetic force due to a permanent magnetization. We restrict our attention to dispersions of micromagnetic composite with negligible Brownian motion. The calculations of the relative particle trajectories are based on direct computations of the hydrodynamic interactions among rigid spheres in the regime of low particle Reynolds number. Depending on the relative importance of the interparticle forces and gravity, the collisions may result in aggregation or simply in a breaking of the particle relative trajectory time reversibility. After summing over all possible encounters, the transverse self-diffusion and down-gradient diffusion coefficients that describe the cross-flow migration of the particles are calculated. Our calculation shows first evidence and the significance of the diffusion process arising from magnetic interactions in dilute non-Brownian suspensions

Transverse gradient diffusion in a polydisperse dilute suspension of magnetic spheres during sedimentation

Energy Technology Data Exchange (ETDEWEB)

Cunha, F R; Couto, H L G [Departamento de Engenharia Mecanica, Universidade de Brasilia, Faculdade de Tecnologia, Grupo de Mecanica dos Fluidos de Escoamentos Complexos-VORTEX, Campus Universitario Darcy Ribeiro, 70910-900, Brasilia, DF (Brazil)], E-mail: frcunha@unb.br

2008-05-21

In this work we investigate the pair interaction of magnetic particles in a dilute polydisperse sedimenting suspension. The suspension is composed of magnetic spherical forms of different radii and densities immersed in a Newtonian fluid, settling due to the gravity. When in close contact, the particles may exert on each other a magnetic force due to a permanent magnetization. We restrict our attention to dispersions of micromagnetic composite with negligible Brownian motion. The calculations of the relative particle trajectories are based on direct computations of the hydrodynamic interactions among rigid spheres in the regime of low particle Reynolds number. Depending on the relative importance of the interparticle forces and gravity, the collisions may result in aggregation or simply in a breaking of the particle relative trajectory time reversibility. After summing over all possible encounters, the transverse self-diffusion and down-gradient diffusion coefficients that describe the cross-flow migration of the particles are calculated. Our calculation shows first evidence and the significance of the diffusion process arising from magnetic interactions in dilute non-Brownian suspensions.

Effects of Fuel Quantity on Soot Formation Process for Biomass-Based Renewable Diesel Fuel Combustion

KAUST Repository

Jing, Wei

2016-12-01

Soot formation process was investigated for biomass-based renewable diesel fuel, such as biomass to liquid (BTL), and conventional diesel combustion under varied fuel quantities injected into a constant volume combustion chamber. Soot measurement was implemented by two-color pyrometry under quiescent type diesel engine conditions (1000 K and 21% O2 concentration). Different fuel quantities, which correspond to different injection widths from 0.5 ms to 2 ms under constant injection pressure (1000 bar), were used to simulate different loads in engines. For a given fuel, soot temperature and KL factor show a different trend at initial stage for different fuel quantities, where a higher soot temperature can be found in a small fuel quantity case but a higher KL factor is observed in a large fuel quantity case generally. Another difference occurs at the end of combustion due to the termination of fuel injection. Additionally, BTL flame has a lower soot temperature, especially under a larger fuel quantity (2 ms injection width). Meanwhile, average soot level is lower for BTL flame, especially under a lower fuel quantity (0.5 ms injection width). BTL shows an overall low sooting behavior with low soot temperature compared to diesel, however, trade-off between soot level and soot temperature needs to be carefully selected when different loads are used.

Detection of Soot Using a Resistivity Sensor Device Employing Thermophoretic Particle Deposition

Directory of Open Access Journals (Sweden)

Doina Lutic

2010-01-01

Full Text Available Results are reported for thermophoretic deposition of soot particles on resistivity sensors as a monitoring technique for diesel exhaust particles with the potential of improved detection limit and sensitivity. Soot with similar characteristics as from diesel exhausts was generated by a propane flame and diluted in stages. The soot in a gas flow at 240–270C∘ was collected on an interdigitated electrode structure held at a considerably lower temperature, 105–125C∘. The time delay for reaching measurable resistance values, the subsequent rate, and magnitude of resistance decrease were a function of the distance between the fingers in the electrodes and the degree of dilution of the soot containing flow. Soot deposition and subsequent removal by heating the sensor support was also performed in a real diesel exhaust. Good similarities between the behavior in our laboratory system and the real diesel exhaust were noticed.

Quantitative characterization of steady and time-varying, sooting, laminar diffusion flames using optical techniques

Science.gov (United States)

Connelly, Blair C.

In order to reduce the emission of pollutants such as soot and NO x from combustion systems, a detailed understanding of pollutant formation is required. In addition to environmental concerns, this is important for a fundamental understanding of flame behavior as significant quantities of soot lower local flame temperatures, increase overall flame length and affect the formation of such temperature-dependent species as NOx. This problem is investigated by carrying out coupled computational and experimental studies of steady and time-varying sooting, coflow diffusion flames. Optical diagnostic techniques are a powerful tool for characterizing combustion systems, as they provide a noninvasive method of probing the environment. Laser diagnostic techniques have added advantages, as systems can be probed with high spectral, temporal and spatial resolution, and with species selectivity. Experimental soot volume fractions were determined by using two-dimensional laser-induced incandescence (LII), calibrated with an on-line extinction measurement, and soot pyrometry. Measurements of soot particle size distributions are made using time-resolved LII (TR-LII). Laser-induced fluorescence measurements are made of NO and formaldehyde. These experimental measurements, and others, are compared with computational results in an effort to understand and model soot formation and to examine the coupled relationship of soot and NO x formation.

Formation, growth, and transport of soot in a three-dimensional turbulent non-premixed jet flame

KAUST Repository

Attili, Antonio; Bisetti, Fabrizio; Mü eller, Michael E.; Pitsch, Heinz G.

2014-01-01

The formation, growth, and transport of soot is investigated via large scale numerical simulation in a three-dimensional turbulent non-premixed n-heptane/air jet flame at a jet Reynolds number of 15,000. For the first time, a detailed chemical mechanism, which includes the soot precursor naphthalene and a high-order method of moments are employed in a three-dimensional simulation of a turbulent sooting flame. The results are used to discuss the interaction of turbulence, chemistry, and the formation of soot. Compared to temperature and other species controlled by oxidation chemistry, naphthalene is found to be affected more significantly by the scalar dissipation rate. While the mixture fraction and temperature fields show fairly smooth spatial and temporal variations, the sensitivity of naphthalene to turbulent mixing causes large inhomogeneities in the precursor fields, which in turn generate even stronger intermittency in the soot fields. A strong correlation is apparent between soot number density and the concentration of naphthalene. On the contrary, while soot mass fraction is usually large where naphthalene is present, pockets of fluid with large soot mass are also frequent in regions with very low naphthalene mass fraction values. From the analysis of Lagrangian statistics, it is shown that soot nucleates and grows mainly in a layer close to the flame and spreads on the rich side of the flame due to the fluctuating mixing field, resulting in more than half of the total soot mass being located at mixture fractions larger than 0.6. Only a small fraction of soot is transported towards the flame and is completely oxidized in the vicinity of the stoichiometric surface. These results show the leading order effects of turbulent mixing in controlling the dynamics of soot in turbulent flames. Finally, given the difficulties in obtaining quantitative data in experiments of turbulent sooting flames, this simulation provides valuable data to guide the development of

Formation, growth, and transport of soot in a three-dimensional turbulent non-premixed jet flame

KAUST Repository

Attili, Antonio

2014-07-01

The formation, growth, and transport of soot is investigated via large scale numerical simulation in a three-dimensional turbulent non-premixed n-heptane/air jet flame at a jet Reynolds number of 15,000. For the first time, a detailed chemical mechanism, which includes the soot precursor naphthalene and a high-order method of moments are employed in a three-dimensional simulation of a turbulent sooting flame. The results are used to discuss the interaction of turbulence, chemistry, and the formation of soot. Compared to temperature and other species controlled by oxidation chemistry, naphthalene is found to be affected more significantly by the scalar dissipation rate. While the mixture fraction and temperature fields show fairly smooth spatial and temporal variations, the sensitivity of naphthalene to turbulent mixing causes large inhomogeneities in the precursor fields, which in turn generate even stronger intermittency in the soot fields. A strong correlation is apparent between soot number density and the concentration of naphthalene. On the contrary, while soot mass fraction is usually large where naphthalene is present, pockets of fluid with large soot mass are also frequent in regions with very low naphthalene mass fraction values. From the analysis of Lagrangian statistics, it is shown that soot nucleates and grows mainly in a layer close to the flame and spreads on the rich side of the flame due to the fluctuating mixing field, resulting in more than half of the total soot mass being located at mixture fractions larger than 0.6. Only a small fraction of soot is transported towards the flame and is completely oxidized in the vicinity of the stoichiometric surface. These results show the leading order effects of turbulent mixing in controlling the dynamics of soot in turbulent flames. Finally, given the difficulties in obtaining quantitative data in experiments of turbulent sooting flames, this simulation provides valuable data to guide the development of

Soot measurements for diesel and biodiesel spray combustion under high temperature highly diluted ambient conditions

KAUST Repository

Zhang, Ji

2014-11-01

This paper presents the soot temperature and KL factor for biodiesel, namely fatty acid methyl ester (FAME) and diesel fuel combustion in a constant volume chamber using a two-color technique. The KL factor is a parameter for soot concentration, where K is an absorption coefficient and proportional to the number density of soot particles, L is the geometric thickness of the flame along the optical detection axis, and KL factor is proportional to soot volume fraction. The main objective is to explore a combustion regime called high-temperature and highly-diluted combustion (HTHDC) and compare it with the conventional and low-temperature combustion (LTC) modes. The three different combustion regimes are implemented under different ambient temperatures (800 K, 1000 K, and 1400 K) and ambient oxygen concentrations (10%, 15%, and 21%). Results are presented in terms of soot temperature and KL factor images, time-resolved pixel-averaged soot temperature, KL factor, and spatially integrated KL factor over the soot area. The time-averaged results for these three regimes are compared for both diesel and biodiesel fuels. Results show complex combined effects of the ambient temperature and oxygen concentration, and that two-color temperature for the HTHDC mode at the 10% oxygen level can actually be lower than the conventional mode. Increasing ambient oxygen and temperature increases soot temperature. Diesel fuel results in higher soot temperature than biodiesel for all three regimes. Results also show that diesel and biodiesel fuels have very different burning and sooting behavior under the three different combustion regimes. For diesel fuel, the HTHDC regime offers better results in terms of lower soot than the conventional and LTC regimes, and the 10% O2, 1400 K ambient condition shows the lowest soot concentration while maintaining a moderate two-color temperature. For biodiesel, the 15% O2, 800 K ambient condition shows some advantages in terms of reducing soot

Investigation of soot formation and temperature field in laminar diffusion flames of LPG-air mixture

Energy Technology Data Exchange (ETDEWEB)

Shahad, Haroun A.K.; Mohammed, Yassar K.A. [Babylon Univ., Dept. of Mechanical Engineering, Babylon (Israel)

2000-11-01

Soot formation and burnout were studied at atmospheric pressure in co-flowing, axisymmetric buoyant laminar diffusion flames and double flames of liquefied petroleum gases (LPG)-air mixtures. In diffusion flames, two different fuel flow rates were examined. In double flames, three different primary air flow rates were examined. A soot sampling probe and a thermocouple were used to measure the local soot mass concentration and flame temperature, respectively. Flame residence time was predicted using a uniformly accelerated motion model as function of axial distance of the flame. The increase of primary air flow rate was found to suppress the energy transfer from the annular region, at which the soot is produced, to the flame axis. The time required to initiate soot formation at the flame axis becomes longer as the primary air is increased. The trend rate of soot formation was found to be similar along the flame axis in all tested diffusion flames. The increase of primary air by 10% of the stoichiometric air requirement of the fuel results in a 70% reduction in maximum soot concentration. The final exhaust of soot, which is determined by the net effect of soot formation and burnout, is much lower in double flames than that in diffusion flames. (Author)

Interdigitated Pt-GaN Schottky interfaces for high-temperature soot-particulate sensing

Science.gov (United States)

So, Hongyun; Hou, Minmin; Jain, Sambhav R.; Lim, Jongwoo; Senesky, Debbie G.

2016-04-01

A microscale soot-particulate sensor using interdigitated platinum-gallium nitride (Pt-GaN) Schottky interfaces was developed to monitor fine soot particles within high-temperature environments (e.g., combustion exhausts and flues). Upon exposure to soot particles (30 to 50 nm in diameter) from an experimental chimney, an increased current (∼43.6%) is observed through the back-to-back Schottky contact to n-type GaN. This is attributed to a reduction in the effective Schottky barrier height (SBH) of ∼10 meV due to the electric field from the charged soot particles in the depletion region and exposed GaN surface. Furthermore, the microfabricated sensor was shown to recover sensitivity and regenerate the sensing response (∼11 meV SBH reduction) after exposure to temperature as high as 550 °C. This study supports the feasibility of a simple and reliable soot sensor to meet the increasing market demand for particulate matter sensing in harsh environments.

Subsonic aircraft soot. A tracer documenting barriers to inter-hemispheric mixing

Energy Technology Data Exchange (ETDEWEB)

Pueschel, R F [NASA Ames Research Center, Moffett Field, CA (United States)

1998-12-31

Meridional observations of soot aerosols and radioactive {sup 14}C, and models of the geographic distribution of nuclear bomb-released {sup 14}C and aircraft-emitted NO{sub x}, all show strong gradients between the hemispheres. Reason for it are decade-long inter-hemispheric mixing times which are much in excess of yearlong stratospheric residence times of tracers. Vertical mixing of soot aerosol is not corroborated by {sup 14}C observations. The reason could be radiometric forces that act on strongly absorbing soot. (author) 10 refs.

Subsonic aircraft soot. A tracer documenting barriers to inter-hemispheric mixing

Energy Technology Data Exchange (ETDEWEB)

Pueschel, R.F. [NASA Ames Research Center, Moffett Field, CA (United States)

1997-12-31

Meridional observations of soot aerosols and radioactive {sup 14}C, and models of the geographic distribution of nuclear bomb-released {sup 14}C and aircraft-emitted NO{sub x}, all show strong gradients between the hemispheres. Reason for it are decade-long inter-hemispheric mixing times which are much in excess of yearlong stratospheric residence times of tracers. Vertical mixing of soot aerosol is not corroborated by {sup 14}C observations. The reason could be radiometric forces that act on strongly absorbing soot. (author) 10 refs.

Comparison of Preparation Methods of Copper Based PGMFree Diesel-Soot Oxidation Catalysts

Directory of Open Access Journals (Sweden)

R. Prasad

2011-05-01

Full Text Available CuO-CeO2 systems have been proposed as a promising catalyst for low temperature diesel-soot oxidation. CuO-CeO2 catalysts prepared by various methods were examined for air oxidation of the soot in a semi batch tubular flow reactor. The air oxidation of soot was carried out under tight contact with soot/catalyst ratio of 1/10. Air flow rate was 150 ml/min, soot-catalyst mixture was 110 mg, heating rate was 5 0C/min. Prepared catalysts were calcined at 500 0C and their stability was examined by further heating to 800 0C for 4 hours. It was found that the selectivity of all the catalysts was nearly 100% to CO2 production. It was observed that the activity and stability of the catalysts greatly influenced by the preparation methods. The strong interaction between CuO and CeO2 is closely related to the preparation route that plays a crucial role in the soot oxidation over the CuO-CeO2 catalysts. The ranking order of the preparation methods of the catalysts in the soot oxidation performance is as follows: sol-gel > urea nitrate combustion > Urea gelation method > thermal decomposition > co-precipitation. Copyright © 2011 BCREC UNDIP. All rights reserved.(Received: 27th June 2010, Revised: 7th August 2010; Accepted: 13rd October 2010[How to Cite: R. Prasad, V.R. Bella. (2011. Comparison of Preparation Methods of Copper Based PGMFree Diesel-Soot Oxidation Catalysts. Bulletin of Chemical Reaction Engineering and Catalysis, 6(1: 15-21. doi:10.9767/bcrec.6.1.822.15-21][How to Link / DOI: http://dx.doi.org/10.9767/bcrec.6.1.822.15-21 || or local: http://ejournal.undip.ac.id/index.php/bcrec/article/view/822 | View in 

Influence of thermal radiation on soot production in Laminar axisymmetric diffusion flames

International Nuclear Information System (INIS)

Demarco, R.; Nmira, F.; Consalvi, J.L.

2013-01-01

The aim of this paper is to study the effect of radiative heat transfer on soot production in laminar axisymmetric diffusion flames. Twenty-four C 1 –C 3 hydrocarbon–air flames, consisting of normal (NDF) and inverse (IDF) diffusion flames at both normal gravity (1 g) and microgravity (0 g), and covering a wide range of conditions affecting radiative heat transfer, were simulated. The numerical model is based on the Steady Laminar Flamelet (SLF) model, a semi-empirical two-equation acetylene/benzene based soot model and the Statistical Narrow Band Correlated K (SNBCK) model coupled to the Finite Volume Method (FVM) to compute thermal radiation. Predictions relative to velocity, temperature, soot volume fraction and radiative losses are on the whole in good agreement with the available experimental data. Model results show that, for all the flames considered, thermal radiation is a crucial process with a view to providing accurate predictions for temperatures and soot concentrations. It becomes increasingly significant from IDFs to NDFs and its influence is much greater as gravity is reduced. The radiative contribution of gas prevails in the weakly-sooting IDFs and in the methane and ethane NDFs, whereas soot radiation dominates in the other flames. However, both contributions are significant in all cases, with the exception of the 1 g IDFs investigated where soot radiation can be ignored. The optically-thin approximation (OTA) was also tested and found to be applicable as long as the optical thickness, based on flame radius and Planck mean absorption coefficient, is less than 0.05. The OTA is reasonable for the IDFs and for most of the 1 g NDFs, but it fails to predict the radiative heat transfer for the 0 g NDFs. The accuracy of radiative-property models was then assessed in the latter cases. Simulations show that the gray approximation can be applied to soot but not to combustion gases. Both the non-gray and gray soot versions of the Full Spectrum Correlated

Simultaneous measurement of the concentrations of soot particles and gas species in light hydrocarbon flames using mass spectrometry

International Nuclear Information System (INIS)

Li, Qingxun; Liu, Fang; Wang, Dezheng; Wang, Tiefeng

2014-01-01

Besides gas species concentrations, soot volume fractions are also important data in the study of flames. This work describes the simultaneous measurement of the concentrations of soot and gas species in light hydrocarbon flames by in situ sampling and mass spectrometry (MS).The reaction medium was frozen by sampling into a very low-pressure tube, and the soot selectivity (proportion of carbon atoms in the reactant converted to soot) was determined from the C and H mass balances using the measured concentrations of the gas species and the mass of soot present per unit gas volume. The H/C ratio of the soot was measured by a thermogravimetry–mass spectrometry combination. The soot volume fraction was calculated from the soot selectivity and density of the soot. The soot selectivity measured by this reduced pressure sampling mass spectrometry (RPSMS) method was verified by measurements using the gravimetric sampling technique where the mass of soot collected in a volume of gas was weighed by a high precision balance. For most of the measurements, the uncertainty in the soot volume fraction was ±5%, but this would be larger when the soot volume fractions are less than 1 ppm. For demonstration, the RPSMS method was used to study a methane fuel-rich flame where the soot volume fractions were 1–5 ppm. The simultaneous measurement of concentrations of soot and gas species is useful for the quantitative study of flames. (paper)

Towards predictive simulations of soot formation: from surrogate to turbulence

Energy Technology Data Exchange (ETDEWEB)

Blanquart, Guillaume [California Inst. of Technology (CalTech), Pasadena, CA (United States)

2017-03-28

The combustion of transportation fuels leads to the formation of several kinds of pollutants, among which are soot particles. These particles, also formed during coal combustion and in fires, are the source of several health problems and environmental issues. Unfortunately, our current understanding of the chemical and physical phenomena leading to the formation of soot particles remains incomplete, and as a result, the predictive capability of our numerical tools is lacking. The objective of the work was to reduce the gap in the present understanding and modeling of soot formation both in laminar and turbulent flames. The effort spanned several length scales from the molecular level to large scale turbulent transport.

Measuring and predicting sooting tendencies of oxygenates, alkanes, alkenes, cycloalkanes, and aromatics on a unified scale

Energy Technology Data Exchange (ETDEWEB)

Das, Dhrubajyoti D.; St. John, Peter C.; McEnally, Charles S.; Kim, Seonah; Pfefferle, Lisa D.

2018-04-01

Databases of sooting indices, based on measuring some aspect of sooting behavior in a standardized combustion environment, are useful in providing information on the comparative sooting tendencies of different fuels or pure compounds. However, newer biofuels have varied chemical structures including both aromatic and oxygenated functional groups, which expands the chemical space of relevant compounds. In this work, we propose a unified sooting tendency database for pure compounds, including both regular and oxygenated hydrocarbons, which is based on combining two disparate databases of yield-based sooting tendency measurements in the literature. Unification of the different databases was made possible by leveraging the greater dynamic range of the color ratio pyrometry soot diagnostic. This unified database contains a substantial number of pure compounds (greater than or equal to 400 total) from multiple categories of hydrocarbons important in modern fuels and establishes the sooting tendencies of aromatic and oxygenated hydrocarbons on the same numeric scale for the first time. Using this unified sooting tendency database, we have developed a predictive model for sooting behavior applicable to a broad range of hydrocarbons and oxygenated hydrocarbons. The model decomposes each compound into single-carbon fragments and assigns a sooting tendency contribution to each fragment based on regression against the unified database. The model's predictive accuracy (as demonstrated by leave-one-out cross-validation) is comparable to a previously developed, more detailed predictive model. The fitted model provides insight into the effects of chemical structure on soot formation, and cases where its predictions fail reveal the presence of more complicated kinetic sooting mechanisms. This work will therefore enable the rational design of low-sooting fuel blends from a wide range of feedstocks and chemical functionalities.

Soot Reactivity in Conventional Combustion and Oxy-fuel Combustion Environments

DEFF Research Database (Denmark)

Abián, María; Jensen, Anker D.; Glarborg, Peter

2012-01-01

A study of the reactivity of soot produced from ethylene pyrolysis at different temperatures and CO2 atmospheres toward O2 and CO2 has been carried out using a thermogravimetric analyzer. The purpose was to quantify how soot reactivity is affected by the gas environment and temperature history of...

A multi-probe thermophoretic soot sampling system for high-pressure diffusion flames

Energy Technology Data Exchange (ETDEWEB)

Vargas, Alex M.; Gülder, Ömer L. [Institute for Aerospace Studies, University of Toronto, Toronto, Ontario M3H 5T6 (Canada)

2016-05-15

Optical diagnostics and physical probing of the soot processes in high pressure combustion pose challenges that are not faced in atmospheric flames. One of the preferred methods of studying soot in atmospheric flames is in situ thermophoretic sampling followed by transmission electron microscopy imaging and analysis for soot sizing and morphology. The application of this method of sampling to high pressures has been held back by various operational and mechanical problems. In this work, we describe a rotating disk multi-probe thermophoretic soot sampling system, driven by a microstepping stepper motor, fitted into a high-pressure chamber capable of producing sooting laminar diffusion flames up to 100 atm. Innovative aspects of the sampling system design include an easy and precise control of the sampling time down to 2.6 ms, avoidance of the drawbacks of the pneumatic drivers used in conventional thermophoretic sampling systems, and the capability to collect ten consecutive samples in a single experimental run. Proof of principle experiments were performed using this system in a laminar diffusion flame of methane, and primary soot diameter distributions at various pressures up to 10 atm were determined. High-speed images of the flame during thermophoretic sampling were recorded to assess the influence of probe intrusion on the flow field of the flame.

Damköhler number effects on soot formation and growth in turbulent nonpremixed flames

KAUST Repository

Attili, Antonio

2015-01-01

The effect of Damköhler number on turbulent nonpremixed sooting flames is investigated via large scale direct numerical simulation in three-dimensional n-heptane/air jet flames at a jet Reynolds number of 15,000 and at three different Damköhler numbers. A reduced chemical mechanism, which includes the soot precursor naphthalene, and a high-order method of moments are employed. At the highest Damköhler number, local extinction is negligible, while flames holes are observed in the two lowest Damköhler number cases. Compared to temperature and other species controlled by fuel oxidation chemistry, naphthalene is found to be affected more significantly by the Damköhler number. Consequently, the overall soot mass fraction decreases by more than one order of magnitude for a fourfold decrease of the Damköhler number. On the contrary, the overall number density of soot particles is approximately the same, but its distribution in mixture fraction space is different in the three cases. The total soot mass growth rate is found to be proportional to the Damköhler number. In the two lowest Da number cases, soot leakage across the flame is observed. Leveraging Lagrangian statistics, it is concluded that soot leakage is due to patches of soot that cross the stoichiometric surface through flame holes. These results show the leading order effects of turbulent mixing in controlling the dynamics of soot in turbulent flames. © 2014 The Combustion Institute. Published by Elsevier Inc. All rights reserved.

Polydispersity effect on solid-fluid transition in hard sphere systems

KAUST Repository

Nogawa, T.; Watanabe, H.; Ito, N.

2010-01-01

The solid-fluid transition of the hard elastic particle system with size polydispersity is studied by molecular dynamics simulations. Using nonequilibrium relaxation from the mixed initial condition we determines the melting point where the first

Size-selective performance evaluation of candidate aerosol inlets using polydisperse aerosols

Data.gov (United States)

U.S. Environmental Protection Agency — Presented are detailed techniques for the generation, collection, and analysis of polydisperse calibration aerosols for wind tunnel evaluation of size-selective...

Detection Limits of DLS and UV-Vis Spectroscopy in Characterization of Polydisperse Nanoparticles Colloids

Directory of Open Access Journals (Sweden)

Emilia Tomaszewska

2013-01-01

Full Text Available Dynamic light scattering is a method that depends on the interaction of light with particles. This method can be used for measurements of narrow particle size distributions especially in the range of 2–500 nm. Sample polydispersity can distort the results, and we could not see the real populations of particles because big particles presented in the sample can screen smaller ones. Although the theory and mathematical basics of DLS technique are already well known, little has been done to determine its limits experimentally. The size and size distribution of artificially prepared polydisperse silver nanoparticles (NPs colloids were studied using dynamic light scattering (DLS and ultraviolet-visible (UV-Vis spectroscopy. Polydisperse colloids were prepared based on the mixture of chemically synthesized monodisperse colloids well characterized by atomic force microscopy (AFM, transmission electron microscopy (TEM, DLS, and UV-Vis spectroscopy. Analysis of the DLS results obtained for polydisperse colloids reveals that several percent of the volume content of bigger NPs could screen completely the presence of smaller ones. The presented results could be extremely important from nanoparticles metrology point of view and should help to understand experimental data especially for the one who works with DLS and/or UV-Vis only.

Fractionating power and outlet stream polydispersity in asymmetrical flow field-flow fractionation. Part I: isocratic operation.

Science.gov (United States)

Williams, P Stephen

2016-05-01

Asymmetrical flow field-flow fractionation (As-FlFFF) has become the most commonly used of the field-flow fractionation techniques. However, because of the interdependence of the channel flow and the cross flow through the accumulation wall, it is the most difficult of the techniques to optimize, particularly for programmed cross flow operation. For the analysis of polydisperse samples, the optimization should ideally be guided by the predicted fractionating power. Many experimentalists, however, neglect fractionating power and rely on light scattering detection simply to confirm apparent selectivity across the breadth of the eluted peak. The size information returned by the light scattering software is assumed to dispense with any reliance on theory to predict retention, and any departure of theoretical predictions from experimental observations is therefore considered of no importance. Separation depends on efficiency as well as selectivity, however, and efficiency can be a strong function of retention. The fractionation of a polydisperse sample by field-flow fractionation never provides a perfectly separated series of monodisperse fractions at the channel outlet. The outlet stream has some residual polydispersity, and it will be shown in this manuscript that the residual polydispersity is inversely related to the fractionating power. Due to the strong dependence of light scattering intensity and its angular distribution on the size of the scattering species, the outlet polydispersity must be minimized if reliable size data are to be obtained from the light scattering detector signal. It is shown that light scattering detection should be used with careful control of fractionating power to obtain optimized analysis of polydisperse samples. Part I is concerned with isocratic operation of As-FlFFF, and part II with programmed operation.

Evaluation of solution stability for two-component polydisperse systems by small-angle scattering

Science.gov (United States)

Kryukova, A. E.; Konarev, P. V.; Volkov, V. V.

2017-12-01

The article is devoted to the modelling of small-angle scattering data using the program MIXTURE designed for the study of polydisperse multicomponent mixtures. In this work we present the results of solution stability studies for theoretical small-angle scattering data sets from two-component models. It was demonstrated that the addition of the noise to the data influences the stability range of the restored structural parameters. The recommendations for the optimal minimization schemes that permit to restore the volume size distributions for polydisperse systems are suggested.

Soot Formation In Turbulent Combusting Flows

National Research Council Canada - National Science Library

Santoro, Robert

1998-01-01

.... Laser-based techniques were used to measure the soot volume fraction, particle size and number density as well as the temperature and relative concentration of hydroxyl radicals and polycyclic aromatic hydrocarbons...

Influence of thermal radiation on soot production in Laminar axisymmetric diffusion flames

Science.gov (United States)

Demarco, R.; Nmira, F.; Consalvi, J. L.

2013-05-01

The aim of this paper is to study the effect of radiative heat transfer on soot production in laminar axisymmetric diffusion flames. Twenty-four C1-C3 hydrocarbon-air flames, consisting of normal (NDF) and inverse (IDF) diffusion flames at both normal gravity (1 g) and microgravity (0 g), and covering a wide range of conditions affecting radiative heat transfer, were simulated. The numerical model is based on the Steady Laminar Flamelet (SLF) model, a semi-empirical two-equation acetylene/benzene based soot model and the Statistical Narrow Band Correlated K (SNBCK) model coupled to the Finite Volume Method (FVM) to compute thermal radiation. Predictions relative to velocity, temperature, soot volume fraction and radiative losses are on the whole in good agreement with the available experimental data. Model results show that, for all the flames considered, thermal radiation is a crucial process with a view to providing accurate predictions for temperatures and soot concentrations. It becomes increasingly significant from IDFs to NDFs and its influence is much greater as gravity is reduced. The radiative contribution of gas prevails in the weakly-sooting IDFs and in the methane and ethane NDFs, whereas soot radiation dominates in the other flames. However, both contributions are significant in all cases, with the exception of the 1 g IDFs investigated where soot radiation can be ignored. The optically-thin approximation (OTA) was also tested and found to be applicable as long as the optical thickness, based on flame radius and Planck mean absorption coefficient, is less than 0.05. The OTA is reasonable for the IDFs and for most of the 1 g NDFs, but it fails to predict the radiative heat transfer for the 0 g NDFs. The accuracy of radiative-property models was then assessed in the latter cases. Simulations show that the gray approximation can be applied to soot but not to combustion gases. Both the non-gray and gray soot versions of the Full Spectrum Correlated k (FSCK

Electrometric aviation soot monitor, Phase I

Data.gov (United States)

National Aeronautics and Space Administration — We propose to develop a highly sensitive and portable device to monitor soot particle mass distribution from aircraft engine exhaust. The proposed method is based on...

A mechanistic study on the simultaneous elimination of soot and nitric oxide from engine exhaust

KAUST Repository

Raj, Abhijeet; Zainuddin, Zakwan; Sander, Markus; Kraft, Markus

2011-01-01

The non-catalytic interaction between soot and nitric oxide (NO) resulting in their simultaneous elimination was studied on different types of reactive site present on soot. The reaction mechanism proposed previously was extended by including seven new reaction pathways for which the reaction energetics and kinetics were studied using density functional theory and transition state theory. This has led to the calculation of a new rate for the removal of carbon monoxide (CO) from soot. The new pathways have been added to our polycyclic aromatic hydrocarbon (PAH) growth model and used to simulate the NO-soot interaction to form CO, N2 and N2O. The simulation results show satisfactory agreement with experiment for the new CO removal rate. The NO-soot reaction was found to depend strongly on the soot site type and temperature. For a set of temperatures, computed PAH structures were analysed to determine the functional groups responsible for the decrease in the reactivity of soot with NO with increasing reaction time. In isothermal conditions, it was found that as temperature is increased, the number of oxygen atoms remaining on the soot surface decreases, while the number of nitrogen atoms increases for a given reaction time. © 2010 Elsevier Ltd. All rights reserved.

A mechanistic study on the simultaneous elimination of soot and nitric oxide from engine exhaust

KAUST Repository

Raj, Abhijeet

2011-04-01

The non-catalytic interaction between soot and nitric oxide (NO) resulting in their simultaneous elimination was studied on different types of reactive site present on soot. The reaction mechanism proposed previously was extended by including seven new reaction pathways for which the reaction energetics and kinetics were studied using density functional theory and transition state theory. This has led to the calculation of a new rate for the removal of carbon monoxide (CO) from soot. The new pathways have been added to our polycyclic aromatic hydrocarbon (PAH) growth model and used to simulate the NO-soot interaction to form CO, N2 and N2O. The simulation results show satisfactory agreement with experiment for the new CO removal rate. The NO-soot reaction was found to depend strongly on the soot site type and temperature. For a set of temperatures, computed PAH structures were analysed to determine the functional groups responsible for the decrease in the reactivity of soot with NO with increasing reaction time. In isothermal conditions, it was found that as temperature is increased, the number of oxygen atoms remaining on the soot surface decreases, while the number of nitrogen atoms increases for a given reaction time. © 2010 Elsevier Ltd. All rights reserved.

Numerical simulation of combustion and soot under partially premixed combustion of low-octane gasoline

KAUST Repository

An, Yanzhao

2017-09-23

In-cylinder combustion visualization and engine-out soot particle emissions were investigated in an optical diesel engine fueled with low octane gasoline. Single injection strategy with an early injection timing (−30 CAD aTDC) was employed to achieve partially premixed combustion (PPC) condition. A high-speed color camera was used to record the combustion images for 150 cycles. The regulated emission of carbon dioxide, carbon monoxide, nitrogen oxides and soot mass concentration were measured experimentally. Full cycle engine simulations were performed using CONVERGE™ and the simulation results matched with the experimental results. The in-cylinder soot particle evolution was performed by coupling a reduced toluene reference fuel mechanism including the PAHs formation/oxidation reactions with particulate size mimic model. The results showed that PPC presents typical stratified combustion characteristics, which is significantly different from the conventional diesel spray-driven combustion. The in-cylinder temperature and equivalence ratio overlaid with soot-NO formation regime revealed that PPC operating condition under study mostly avoided the main sooting conditions throughout the entire combustion. The evaluation of temperature distribution showed formaldehyde could be regarded as an indicator for low temperature reactions, while hydroxyl group represents the high temperature reactions. Soot evolution happened during the combustion process, hydroxyl radicals promoted the soot oxidation.

Numerical simulation of combustion and soot under partially premixed combustion of low-octane gasoline

KAUST Repository

An, Yanzhao; Jaasim, Mohammed; Vallinayagam, R.; Vedharaj, S.; Im, Hong G.; Johansson, Bengt.

2017-01-01

In-cylinder combustion visualization and engine-out soot particle emissions were investigated in an optical diesel engine fueled with low octane gasoline. Single injection strategy with an early injection timing (−30 CAD aTDC) was employed to achieve partially premixed combustion (PPC) condition. A high-speed color camera was used to record the combustion images for 150 cycles. The regulated emission of carbon dioxide, carbon monoxide, nitrogen oxides and soot mass concentration were measured experimentally. Full cycle engine simulations were performed using CONVERGE™ and the simulation results matched with the experimental results. The in-cylinder soot particle evolution was performed by coupling a reduced toluene reference fuel mechanism including the PAHs formation/oxidation reactions with particulate size mimic model. The results showed that PPC presents typical stratified combustion characteristics, which is significantly different from the conventional diesel spray-driven combustion. The in-cylinder temperature and equivalence ratio overlaid with soot-NO formation regime revealed that PPC operating condition under study mostly avoided the main sooting conditions throughout the entire combustion. The evaluation of temperature distribution showed formaldehyde could be regarded as an indicator for low temperature reactions, while hydroxyl group represents the high temperature reactions. Soot evolution happened during the combustion process, hydroxyl radicals promoted the soot oxidation.

The competition between mineral dust and soot ice nuclei in mixed-phase clouds (Invited)

Science.gov (United States)

Murray, B. J.; Atkinson, J.; Umo, N.; Browse, J.; Woodhouse, M. T.; Whale, T.; Baustian, K. J.; Carslaw, K. S.; Dobbie, S.; O'Sullivan, D.; Malkin, T. L.

2013-12-01

The amount of ice present in mixed-phase clouds, which contain both supercooled liquid water droplets and ice particles, affects cloud extent, lifetime, particle size and radiative properties. The freezing of cloud droplets can be catalysed by the presence of aerosol particles known as ice nuclei. In this talk our recent laboratory and global aerosol modelling work on mineral dust and soot ice nuclei will be presented. We have performed immersion mode experiments to quantify ice nucleation by the individual minerals which make up desert mineral dusts and have shown that the feldspar component, rather than the clay component, is most important for ice nucleation (Atkinson et al. 2013). Experiments with well-characterised soot generated with eugenol, an intermediate in biomass burning, and n-decane show soot has a significant ice nucleation activity in mixed-phase cloud conditions. Our results for soot are in good agreement with previous results for acetylene soot (DeMott, 1990), but extend the efficiency to much higher temperatures. We then use a global aerosol model (GLOMAP) to map the distribution of soot and feldspar particles on a global basis. We show that below about -15oC that dust and soot together can explain most observed ice nuclei in the Earth's atmosphere, while at warmer temperatures other ice nuclei types are needed. We show that in some regions soot is the most important ice nuclei (below -15oC), while in others feldspar dust dominates. Our results suggest that there is a strong anthropogenic contribution to the ice nuclei population, since a large proportion of soot aerosol in the atmosphere results from human activities. Atkinson, J. D., Murray, B. J., Woodhouse, M. T., Carslaw, K. S., Whale, T. F., Baustian, K. J., Dobbie, S., O'Sullivan, D., and Malkin, T. L.: The importance of feldspar for ice nucleation by mineral dust in mixed-phase clouds, Nature, 10.1038/nature12278, (2013). Demott, P. J. 1990. An Exploratory-Study of Ice Nucleation by Soot

A Progress Review on Soot Experiments and Modeling in the Engine Combustion Network (ECN)

KAUST Repository

Skeen, Scott A.

2016-04-05

The 4th Workshop of the Engine Combustion Network (ECN) was held September 5-6, 2015 in Kyoto, Japan. This manuscript presents a summary of the progress in experiments and modeling among ECN contributors leading to a better understanding of soot formation under the ECN “Spray A” configuration and some parametric variants. Relevant published and unpublished work from prior ECN workshops is reviewed. Experiments measuring soot particle size and morphology, soot volume fraction (fv), and transient soot mass have been conducted at various international institutions providing target data for improvements to computational models. Multiple modeling contributions using both the Reynolds Averaged Navier-Stokes (RANS) Equations approach and the Large-Eddy Simulation (LES) approach have been submitted. Among these, various chemical mechanisms, soot models, and turbulence-chemistry interaction (TCI) methodologies have been considered.

A Progress Review on Soot Experiments and Modeling in the Engine Combustion Network (ECN)

KAUST Repository

Skeen, Scott A.; Manin, Julien; Pickett, Lyle M.; Cenker, Emre; Bruneaux, Gilles; Kondo, Katsufumi; Aizawa, Tets; Westlye, Fredrik; Dalen, Kristine; Ivarsson, Anders; Xuan, Tiemin; Garcia-Oliver, Jose M; Pei, Yuanjiang; Som, Sibendu; Hu, Wang; Reitz, Rolf D.; Lucchini, Tommaso; D'Errico, Gianluca; Farrace, Daniele; Pandurangi, Sushant S.; Wright, Yuri M.; Chishty, Muhammad Aqib; Bolla, Michele; Hawkes, Evatt

2016-01-01

The 4th Workshop of the Engine Combustion Network (ECN) was held September 5-6, 2015 in Kyoto, Japan. This manuscript presents a summary of the progress in experiments and modeling among ECN contributors leading to a better understanding of soot formation under the ECN “Spray A” configuration and some parametric variants. Relevant published and unpublished work from prior ECN workshops is reviewed. Experiments measuring soot particle size and morphology, soot volume fraction (fv), and transient soot mass have been conducted at various international institutions providing target data for improvements to computational models. Multiple modeling contributions using both the Reynolds Averaged Navier-Stokes (RANS) Equations approach and the Large-Eddy Simulation (LES) approach have been submitted. Among these, various chemical mechanisms, soot models, and turbulence-chemistry interaction (TCI) methodologies have been considered.

Microstructure and macroscopic properties of polydisperse systems of hard spheres

NARCIS (Netherlands)

Ogarko, V.

2014-01-01

This dissertation describes an investigation of systems of polydisperse smooth hard spheres. This includes the development of a fast contact detection algorithm for computer modelling, the development of macroscopic constitutive laws that are based on microscopic features such as the moments of the

Soot and Spectral Radiation Modeling for a High-Pressure Turbulent Spray Flame

Energy Technology Data Exchange (ETDEWEB)

Ferreryo-Fernandez, Sebastian [Pennsylvania State Univ., University Park, PA (United States); Paul, Chandan [Pennsylvania State Univ., University Park, PA (United States); Sircar, Arpan [Pennsylvania State Univ., University Park, PA (United States); Imren, Abdurrahman [Pennsylvania State Univ., University Park, PA (United States); Haworth, Daniel C [Pennsylvania State Univ., University Park, PA (United States); Roy, Somesh P [Marquette University (United States); Modest, Michael F [University of California Merced (United States)

2017-04-26

Simulations are performed of a transient high-pressure turbulent n-dodecane spray flame under engine-relevant conditions. An unsteady RANS formulation is used, with detailed chemistry, a semi-empirical two-equation soot model, and a particle-based transported composition probability density function (PDF) method to account for unresolved turbulent fluctuations in composition and temperature. Results from the PDF model are compared with those from a locally well-stirred reactor (WSR) model to quantify the effects of turbulence-chemistry-soot interactions. Computed liquid and vapor penetration versus time, ignition delay, and flame lift-off height are in good agreement with experiment, and relatively small differences are seen between the WSR and PDF models for these global quantities. Computed soot levels and spatial soot distributions from the WSR and PDF models show large differences, with PDF results being in better agreement with experimental measurements. An uncoupled photon Monte Carlo method with line-by-line spectral resolution is used to compute the spectral intensity distribution of the radiation leaving the flame. This provides new insight into the relative importance of molecular gas radiation versus soot radiation, and the importance of turbulent fluctuations on radiative heat transfer.

Fragmentation and bond strength of airborne diesel soot agglomerates

Directory of Open Access Journals (Sweden)

Messerer Armin

2008-06-01

Full Text Available Abstract Background The potential of diesel soot aerosol particles to break up into smaller units under mechanical stress was investigated by a direct impaction technique which measures the degree of fragmentation of individual agglomerates vs. impact energy. Diesel aerosol was generated by an idling diesel engine used for passenger vehicles. Both the aerosol emitted directly and aerosol that had undergone additional growth by Brownian coagulation ("aging" was investigated. Optionally a thermo-desoption technique at 280°C was used to remove all high-volatility and the majority of low-volatility HC adsorbates from the aerosol before aging. Results It was found that the primary soot agglomerates emitted directly from the engine could not be fragmented at all. Soot agglomerates permitted to grow additionally by Brownian coagulation of the primary emitted particles could be fragmented to a maximum of 75% and 60% respectively, depending on whether adsorbates were removed from their surface prior to aging or not. At most, these aged agglomerates could be broken down to roughly the size of the agglomerates from the primary emission. The energy required for a 50% fragmentation probability of all bonds within an agglomerate was reduced by roughly a factor of 2 when aging "dry" agglomerates. Average bond energies derived from the data were 0.52*10-16 and 1.2*10-16 J, respectively. This is about 2 orders of magnitude higher than estimates for pure van-der-Waals agglomerates, but agrees quite well with other observations. Conclusion Although direct conclusions regarding the behavior of inhaled diesel aerosol in contact with body fluids cannot be drawn from such measurements, the results imply that highly agglomerated soot aerosol particles are unlikely to break up into units smaller than roughly the size distribution emitted as tail pipe soot.

Fragmentation and bond strength of airborne diesel soot agglomerates

Science.gov (United States)

Rothenbacher, Sonja; Messerer, Armin; Kasper, Gerhard

2008-01-01

Background The potential of diesel soot aerosol particles to break up into smaller units under mechanical stress was investigated by a direct impaction technique which measures the degree of fragmentation of individual agglomerates vs. impact energy. Diesel aerosol was generated by an idling diesel engine used for passenger vehicles. Both the aerosol emitted directly and aerosol that had undergone additional growth by Brownian coagulation ("aging") was investigated. Optionally a thermo-desoption technique at 280°C was used to remove all high-volatility and the majority of low-volatility HC adsorbates from the aerosol before aging. Results It was found that the primary soot agglomerates emitted directly from the engine could not be fragmented at all. Soot agglomerates permitted to grow additionally by Brownian coagulation of the primary emitted particles could be fragmented to a maximum of 75% and 60% respectively, depending on whether adsorbates were removed from their surface prior to aging or not. At most, these aged agglomerates could be broken down to roughly the size of the agglomerates from the primary emission. The energy required for a 50% fragmentation probability of all bonds within an agglomerate was reduced by roughly a factor of 2 when aging "dry" agglomerates. Average bond energies derived from the data were 0.52*10-16 and 1.2*10-16 J, respectively. This is about 2 orders of magnitude higher than estimates for pure van-der-Waals agglomerates, but agrees quite well with other observations. Conclusion Although direct conclusions regarding the behavior of inhaled diesel aerosol in contact with body fluids cannot be drawn from such measurements, the results imply that highly agglomerated soot aerosol particles are unlikely to break up into units smaller than roughly the size distribution emitted as tail pipe soot. PMID:18533015

Post-depositional enrichment of black soot in snow-pack and accelerated melting of Tibetan glaciers

International Nuclear Information System (INIS)

Xu Baiqing; Joswiak, Daniel R; Zhao Huabiao; Cao Junji; Liu Xianqin; He Jianqiao

2012-01-01

The post-depositional enrichment of black soot in snow-pack was investigated by measuring the redistribution of black soot along monthly snow-pits on a Tien Shan glacier. The one-year experiment revealed that black soot was greatly enriched, defined as the ratio of concentration to original snow concentration, in the unmelted snow-pack by at least an order of magnitude. Greatest soot enrichment was observed in the surface snow and the lower firn-pack within the melt season percolation zone. Black carbon (BC) concentrations as high as 400 ng g −1 in the summer surface snow indicate that soot can significantly contribute to glacier melt. BC concentrations reaching 3000 ng g −1 in the bottom portion of the firn pit are especially concerning given the expected equilibrium-line altitude (ELA) rise associated with future climatic warming, which would expose the dirty underlying firn and ice. Since most of the accumulation area on Tibetan glaciers is within the percolation zone where snow densification is characterized by melting and refreezing, the enrichment of black soot in the snow-pack is of foremost importance. Results suggest the effect of black soot on glacier melting may currently be underestimated. (letter)

Effects of diluents on soot surface temperature and volume fraction in diluted ethylene diffusion flames at pressure

KAUST Repository

Kailasanathan, Ranjith Kumar Abhinavam

2014-05-20

Soot surface temperature and volume fraction are measured in ethylene/air coflowing laminar diffusion flames at high pressures, diluted with one of four diluents (argon, helium, nitrogen, and carbon dioxide) using a two-color technique. Both temperature and soot measurements presented are line-of-sight averages. The results aid in understanding the kinetic and thermodynamic behavior of the soot formation and oxidation chemistry with changes in diluents, ultimately leading to possible methods of reducing soot emission from practical combustion hardware. The diluted fuel and coflow exit velocities (top-hat profiles) were matched at all pressures to minimize shear effects. In addition to the velocity-matched flow rates, the mass fluxes were held constant for all pressures. Addition of a diluent has a pronounced effect on both the soot surface temperature and volume fraction, with the helium diluted flame yielding the maximum and carbon dioxide diluted flame yielding minimum soot surface temperature and volume fraction. At low pressures, peak soot volume fraction exists at the tip of the flame, and with an increase in pressure, the location shifts lower to the wings of the flame. Due to the very high diffusivity of helium, significantly higher temperature and volume fraction are measured and explained. Carbon dioxide has the most dramatic soot suppression effect. By comparing the soot yield with previously measured soot precursor concentrations in the same flame, it is clear that the lower soot yield is a result of enhanced oxidation rates rather than a reduction in precursor formation. Copyright © 2014 Taylor & Francis Group, LLC.

Modelling thermal radiation and soot formation in buoyant diffusion flames

International Nuclear Information System (INIS)

Demarco Bull, R.A.

2012-01-01

The radiative heat transfer plays an important role in fire problems since it is the dominant mode of heat transfer between flames and surroundings. It controls the pyrolysis, and therefore the heat release rate, and the growth rate of the fire. In the present work a numerical study of buoyant diffusion flames is carried out, with the main objective of modelling the thermal radiative transfer and the soot formation/destruction processes. In a first step, different radiative property models were tested in benchmark configurations. It was found that the FSCK coupled with the Modest and Riazzi mixing scheme was the best compromise in terms of accuracy and computational requirements, and was a good candidate to be implemented in CFD codes dealing with fire problems. In a second step, a semi-empirical soot model, considering acetylene and benzene as precursor species for soot nucleation, was validated in laminar co flow diffusion flames over a wide range of hydrocarbons (C1-C3) and conditions. In addition, the optically-thin approximation was found to produce large discrepancies in the upper part of these small laminar flames. Reliable predictions of soot volume fractions require the use of an advanced radiation model. Then the FSCK and the semi-empirical soot model were applied to simulate laboratory-scale and intermediate-scale pool fires of methane and propane. Predicted flame structures as well as the radiant heat flux transferred to the surroundings were found to be in good agreement with the available experimental data. Finally, the interaction between radiation and turbulence was quantified. (author)

Local order and crystallization of dense polydisperse hard spheres

Science.gov (United States)

Coslovich, Daniele; Ozawa, Misaki; Berthier, Ludovic

2018-04-01

Computer simulations give precious insight into the microscopic behavior of supercooled liquids and glasses, but their typical time scales are orders of magnitude shorter than the experimentally relevant ones. We recently closed this gap for a class of models of size polydisperse fluids, which we successfully equilibrate beyond laboratory time scales by means of the swap Monte Carlo algorithm. In this contribution, we study the interplay between compositional and geometric local orders in a model of polydisperse hard spheres equilibrated with this algorithm. Local compositional order has a weak state dependence, while local geometric order associated to icosahedral arrangements grows more markedly but only at very high density. We quantify the correlation lengths and the degree of sphericity associated to icosahedral structures and compare these results to those for the Wahnström Lennard-Jones mixture. Finally, we analyze the structure of very dense samples that partially crystallized following a pattern incompatible with conventional fractionation scenarios. The crystal structure has the symmetry of aluminum diboride and involves a subset of small and large particles with size ratio approximately equal to 0.5.

Soot and liquid-phase fuel distributions in a newly designed optically accessible DI diesel engine

Science.gov (United States)

Dec, J. E.; Espey, C.

1993-10-01

Two-dimensional (2-D) laser-sheet imaging has been used to examine the soot and liquid-phase fuel distributions in a newly designed, optically accessible, direct-injection diesel engine of the heavy-duty size class. The design of this engine preserves the intake port geometry and basic dimensions of a Cummins N-series production engine. It also includes several unique features to provide considerable optical access. Liquid-phase fuel and soot distribution studies were conducted at a medium speed (1,200 rpm) using a Cummins closed-nozzle fuel injector. The scattering was used to obtain planar images of the liquid-phase fuel distribution. These images show that the leading edge of the liquid-phase portion of the fuel jet reaches a maximum length of 24 mm, which is about half the combustion bowl radius for this engine. Beyond this point virtually all the fuel has vaporized. Soot distribution measurements were made at a high load condition using three imaging diagnostics: natural flame luminosity, 2-D laser-induced incandescence, and 2-D elastic scattering. This investigation showed that the soot distribution in the combusting fuel jet develops through three stages. First, just after the onset of luminous combustion, soot particles are small and nearly uniformly distributed throughout the luminous region of the fuel jet. Second, after about 2 crank angle degrees a pattern develops of a higher soot concentration of larger sized particles in the head vortex region of the jet and a lower soot concentration of smaller sized particles upstream toward the injector. Third, after fuel injection ends, both the soot concentration and soot particle size increase rapidly in the upstream portion of the fuel jet.

Investigations of the long-term effects of LII on soot and bath gas

KAUST Repository

Cenker, Emre; Bennett, A.; Roberts, William L.

2017-01-01

A combination of high-repetition rate imaging, laser extinction measurements, two-colour soot pyrometry imaging, and high-resolution transmission electron microscopy of thermophoretically sampled soot is used to investigate the long

Molecular modelling investigations on the possibility of phenanthrene dimers to be the primary nuclei of soot

Science.gov (United States)

Wei, Mingrui; Wu, Sheng; Li, Fan; Zhang, Dongju; Zhang, Tingting; Guo, Guanlun

2017-11-01

Pyrene dimerisation was successfully used to model the beginning of soot nucleation in some simulation models. However, the quantum mechanics (QM) calculations proved that the binding energy of a PAH dimer with three six-member rings was similar to that of a pyrene dimer. Meanwhile, the high concentration of phenanthrene at flame conditions indicated high probability of collisions among them. The small difference of the binding energy and high concentration indicated that PAHs structurally smaller than pyrene also could be involved in soot inception. Hence, binary collisions of phenanthrene were simulated to find out whether phenanthrene dimers can serve as soot primary nuclei or not by using non-equilibrium molecular dynamics (MD). Three temperatures, six collision orientations and 155 initial translational velocities (ITVs) were considered. The results indicated that the number of dimers with lifetime over 10 ps which can serve as soot nuclei decreased from 52 at 1000 K to 17 at 1600 K, and further to 6 at 2400 K, which means that low temperature was more favourable for phenanthrene to form soot nuclei. Meanwhile, no soot nuclei were formed at the high velocity region (HVR), compared to 43 and 9 at low and middle velocity regions (LVR and MVR), respectively, when temperature was 1000 K. Also, no soot nuclei were formed at HVR when the temperature was raised to 1600 K and 2400 K. This indicated that HVR was unfavourable for phenanthrene to form soot nuclei. The results computationally further illustrated that small PAHs such as phenanthrene could serve as soot primary nuclei, since they have similar mole fractions in some flames. This may be useful for future soot simulation models.

Planar measurements of soot volume fraction and OH in a JP-8 pool fire

Energy Technology Data Exchange (ETDEWEB)

Henriksen, Tara L.; Ring, Terry A.; Eddings, Eric G. [Department of Chemical Engineering, University of Utah, Salt Lake City, UT 84112 (United States); Nathan, Graham J. [School of Mechanical Engineering, University of Adelaide, SA 5005 (Australia); Alwahabi, Zeyad T.; Qamar, Nader [School of Chemical Engineering, University of Adelaide, SA 5005 (Australia)

2009-07-15

The simultaneous measurement of soot volume fraction by laser induced incandescence (LII) and qualitative imaging of OH by laser induced fluorescence (LIF) was performed in a JP-8 pool fire contained in a 152 mm diameter pan. Line of sight extinction was used to calibrate the LII system in a laminar flame, and to provide an independent method of measuring average soot volume fraction in the turbulent flame. The presence of soot in the turbulent flame was found to be approximately 50% probable, resulting in high levels of optical extinction, which increased slightly through the flame from approximately 30% near the base, to approximately 50% at the tip. This high soot loading pushes both techniques toward their detection limit. Nevertheless, useful accuracy was obtained, with the LII measurement of apparent extinction in the turbulent flame being approximately 21% lower than a direct measurement, consistent with the influence of signal trapping. The axial and radial distributions of soot volume fraction are presented, along with PDFs of volume fraction, and new insight into the behavior of soot sheets in pool fires are sought from the simultaneous measurements of OH and LII. (author)

Estimation of the Diesel Particulate Filter Soot Load Based on an Equivalent Circuit Model

Directory of Open Access Journals (Sweden)

Yanting Du

2018-02-01

Full Text Available In order to estimate the diesel particulate filter (DPF soot load and improve the accuracy of regeneration timing, a novel method based on an equivalent circuit model is proposed based on the electric-fluid analogy. This proposed method can reduce the impact of the engine transient operation on the soot load, accurately calculate the flow resistance, and improve the estimation accuracy of the soot load. Firstly, the least square method is used to identify the flow resistance based on the World Harmonized Transient Cycle (WHTC test data, and the relationship between flow resistance, exhaust temperature and soot load is established. Secondly, the online estimation of the soot load is achieved by using the dual extended Kalman filter (DEKF. The results show that this method has good convergence and robustness with the maximal absolute error of 0.2 g/L at regeneration timing, which can meet engineering requirements. Additionally, this method can estimate the soot load under engine transient operating conditions and avoids a large number of experimental tests, extensive calibration and the analysis of complex chemical reactions required in traditional methods.

Quantifying uncertainty in soot volume fraction estimates using Bayesian inference of auto-correlated laser-induced incandescence measurements

Science.gov (United States)

Hadwin, Paul J.; Sipkens, T. A.; Thomson, K. A.; Liu, F.; Daun, K. J.

2016-01-01

Auto-correlated laser-induced incandescence (AC-LII) infers the soot volume fraction (SVF) of soot particles by comparing the spectral incandescence from laser-energized particles to the pyrometrically inferred peak soot temperature. This calculation requires detailed knowledge of model parameters such as the absorption function of soot, which may vary with combustion chemistry, soot age, and the internal structure of the soot. This work presents a Bayesian methodology to quantify such uncertainties. This technique treats the additional "nuisance" model parameters, including the soot absorption function, as stochastic variables and incorporates the current state of knowledge of these parameters into the inference process through maximum entropy priors. While standard AC-LII analysis provides a point estimate of the SVF, Bayesian techniques infer the posterior probability density, which will allow scientists and engineers to better assess the reliability of AC-LII inferred SVFs in the context of environmental regulations and competing diagnostics.

Effects of methyl group on aromatic hydrocarbons on the nanostructures and oxidative reactivity of combustion-generated soot

KAUST Repository

Guerrero Peñ a, Gerardo D.J.; Alrefaai, Mhd Maher; Yang, Seung Yeon; Raj, Abhijeet; Brito, Joaquin L.; Stephen, Samuel; Anjana, Tharalekshmy; Pillai, Vinu; Al Shoaibi, Ahmed; Chung, Suk-Ho

2016-01-01

The substituted and unsubstituted aromatic hydrocarbons, present in transportation fuels such as gasoline and diesel, are thought to be responsible for most of the soot particles produced during their combustion. However, the effects of the substituted alkyl groups on the aromatic hydrocarbons on their sooting tendencies, and on the physical and chemical properties of soot produced from them are not well understood. In this work, the effect of the presence of methyl groups on aromatic hydrocarbons on their sooting propensity, and on the oxidative reactivity, morphology, and chemical composition of soot generated from them in diffusion flames is studied using benzene, toluene, and m-xylene as fuels. Several experimental techniques including high resolution transmission electron microscopy and X-ray diffraction are used to identify the morphological changes in soot, whereas the elemental and thermo-gravimetric analyses, electron energy loss spectroscopy, and Fourier transform infrared spectroscopy are used to study the changes in its chemical properties and reactivity. The activation energies for soot oxidation are calculated at different conversion levels, and a trend in the reactivity of soots from benzene, toluene and m-xylene is reported. It is observed that the sizes of primary particles and graphene-like sheets, and the concentrations of aliphatics and oxygenated groups in soot particles decreased with the addition of methyl group(s) on the aromatic ring. The physicochemical changes in soot are found to support the oxidative reactivity trends. © 2016 The Combustion Institute

Effects of methyl group on aromatic hydrocarbons on the nanostructures and oxidative reactivity of combustion-generated soot

KAUST Repository

Guerrero Peña, Gerardo D.J.

2016-07-23

The substituted and unsubstituted aromatic hydrocarbons, present in transportation fuels such as gasoline and diesel, are thought to be responsible for most of the soot particles produced during their combustion. However, the effects of the substituted alkyl groups on the aromatic hydrocarbons on their sooting tendencies, and on the physical and chemical properties of soot produced from them are not well understood. In this work, the effect of the presence of methyl groups on aromatic hydrocarbons on their sooting propensity, and on the oxidative reactivity, morphology, and chemical composition of soot generated from them in diffusion flames is studied using benzene, toluene, and m-xylene as fuels. Several experimental techniques including high resolution transmission electron microscopy and X-ray diffraction are used to identify the morphological changes in soot, whereas the elemental and thermo-gravimetric analyses, electron energy loss spectroscopy, and Fourier transform infrared spectroscopy are used to study the changes in its chemical properties and reactivity. The activation energies for soot oxidation are calculated at different conversion levels, and a trend in the reactivity of soots from benzene, toluene and m-xylene is reported. It is observed that the sizes of primary particles and graphene-like sheets, and the concentrations of aliphatics and oxygenated groups in soot particles decreased with the addition of methyl group(s) on the aromatic ring. The physicochemical changes in soot are found to support the oxidative reactivity trends. © 2016 The Combustion Institute

Comparison of soot formation for diesel and jet-a in a constant volume combustion chamber using two-color pyrometry

KAUST Repository

Jing, Wei

2014-04-01

The measurement of the two-color line of sight soot and KL factor for NO.2 diesel and jet-A fuels was conducted in an optical constant volume combustion chamber by using a high speed camera under 1000 K ambient temperature and varied oxygen concentration conditions. The ambient conditions were set as follows: four oxygen cases including 10%, 15%, 18% and 21% at 1000 K ambient temperature. KL factor and soot temperature were determined based on the two-color pyrometry technique using two band-pass filters with wavelengths of 650 nm and 550 nm. The results show that low soot temperature is observed in the upstream inner flame along the centerline, which is surrounded by high soot temperature regions, and a high KL factor is found in the same region with a low soot temperature. The results under different times suggest that soot temperature is higher for high O2 conditions during the entire flame development; meanwhile, both integrated KL factor and soot area decrease with the increase of O2 concentration. The two fuels share a similar trend of soot temperature and KL factor, however, diesel flame has a higher soot temperature and a larger high soot temperature area compared to jet-A flame. On the other hand, diesel flame shows a lower soot level during the quasi-steady state with a higher total soot level at the end of the combustion under low O2 conditions. A lower O2 concentration range from 10% to 15% is expected to have the possibility to achieve a simultaneous reduction of soot and NOx in sooting flames under the 1000 K ambient temperature condition. Copyright © 2014 SAE International.

Liquid-vapour phase behaviour of a polydisperse Lennard-Jones fluid

International Nuclear Information System (INIS)

Wilding, Nigel B; Sollich, Peter

2005-01-01

We describe a simulation study of the liquid-vapour phase behaviour of a model polydisperse fluid. Particle interactions are given by a Lennard-Jones potential in which polydispersity features both in the particle sizes and the amplitude of their interactions. We address the computational problem of accurately locating the cloud curve for such a system using Monte Carlo simulations within the grand canonical ensemble. The strongly nonlinear variation of the fractional volumes of the phases across the coexistence region precludes naive extrapolation to determine the cloud point density. Instead we propose an improved estimator for the cloud point location and use scaling arguments to predicts its finite-size behaviour. Excellent agreement is found with the simulation results. Application of the method reveals that the measured cloud curve is highly sensitive to the presence of large particles, even when they are extremely rare. This finding is expected to have implications for the reproducibility of experimentally measured phase diagrams in colloids and polymers

Soot particles at an elevated site in eastern China during the passage of a strong cyclone

Energy Technology Data Exchange (ETDEWEB)

Niu, Hongya [State Key Laboratory of Coal Resources and Safe Mining, School of Geoscience and Surveying Engineering, China University of Mining and Technology, Beijing 100083 (China); Faculty of Environmental and Symbiotic Sciences, Prefectural University of Kumamoto, Kumamoto 862-8502 (Japan); Shao, Longyi [State Key Laboratory of Coal Resources and Safe Mining, School of Geoscience and Surveying Engineering, China University of Mining and Technology, Beijing 100083 (China); Zhang, Daizhou, E-mail: dzzhang@pu-kumamoto.ac.jp [Faculty of Environmental and Symbiotic Sciences, Prefectural University of Kumamoto, Kumamoto 862-8502 (Japan)

2012-07-15

Atmospheric particles larger than 0.2 {mu}m were collected at the top of Mt. Tai (36.25 Degree-Sign N, 117.10 Degree-Sign E, 1534 m a.s.l.) in eastern China in May 2008 during the passage of a strong cyclone. The particles were analyzed with electron microscopes and characterized by morphology, equivalent diameter and elemental composition. Soot particles with coating (coated soot particles) and those without apparent coating (naked soot particles) were predominant in the diameter range smaller than 0.6 {mu}m in all samples. The number-size distribution of the relative abundance of naked soot particles in the prefrontal air was similar to that in the postfrontal air and their size modes were around 0.2-0.3 {mu}m. However, the distribution of inclusions of coated soot particles showed a mode in the range of 0.1-0.3 {mu}m. The coating degree of coated soot particles, which was defined by the ratio of the diameter of inclusion to the diameter of particle body, showed a mode around 0.5 with the range of 0.3-0.6. These results indicate that the status of soot particles in the prefrontal and postfrontal air was similar although air pollution levels were dramatically different. In addition, the relative abundance of accumulation mode particles increased with the decrease of soot particles after the front passage. - Highlights: Black-Right-Pointing-Pointer Particles at an elevated site in eastern China in a strong cyclone were studied. Black-Right-Pointing-Pointer Aged status of soot particles in the prefrontal and postfrontal air was similar. Black-Right-Pointing-Pointer Soot particles in elevated layers could be considered as aged ones.

Diffusion air effects on the soot axial distribution concentration in a premixed acetylene/air flame

Energy Technology Data Exchange (ETDEWEB)

Fassani, Fabio Luis; Santos, Alex Alisson Bandeira; Goldstein Junior, Leonardo [Universidade Estadual de Campinas, SP (Brazil). Faculdade de Engenharia Mecanica. Dept. de Engenharia Termica e de Fluidos]. E-mails: fassani@fem.unicamp.br; absantos@fem.unicamp.br; leonardo@fem.unicamp.br; Ferrari, Carlos Alberto [Universidade Estadual de Campinas, SP (Brazil). Inst. de Fisica. Dept. de Eletronica Quantica]. E-mail: ferrari@ifi.unicamp.br

2000-07-01

Soot particles are produced during the high temperature pyrolysis or combustion of hydrocarbons. The emission of soot from a combustor, or from a flame, is determined by the competition between soot formation and its oxidation. Several factors affect these processes, including the type of fuel, the air-to-fuel ratio, flame temperature, pressure, and flow pattern. In this paper, the influence of the induced air diffusion on the soot axial distribution concentration in a premixed acetylene/air flame was studied. The flame was generated in a vertical axis burner in which the fuel - oxidant mixture flow was surrounded by a nitrogen discharge coming from the annular region between the burner tube and an external concentric tube. The nitrogen flow provided a shield that protected the flame from the diffusion of external air, enabling its control. The burner was mounted on a step-motor driven, vertical translation table. The use of several air-to-fuel ratios made possible to establish the sooting characteristics of this flame, by measuring soot concentration along the flame height with a non-intrusive laser light absorption technique. (author)

Dynamics of highly polydisperse colloidal suspensions as a model system for bacterial cytoplasm.

Science.gov (United States)

Hwang, Jiye; Kim, Jeongmin; Sung, Bong June

2016-08-01

There are various kinds of macromolecules in bacterial cell cytoplasm. The size polydispersity of the macromolecules is so significant that the crystallization and the phase separation could be suppressed, thus stabilizing the liquid state of bacterial cytoplasm. On the other hand, recent experiments suggested that the macromolecules in bacterial cytoplasm should exhibit glassy dynamics, which should be also affected significantly by the size polydispersity of the macromolecules. In this work, we investigate the anomalous and slow dynamics of highly polydisperse colloidal suspensions, of which size distribution is chosen to mimic Escherichia coli cytoplasm. We find from our Langevin dynamics simulations that the diffusion coefficient (D_{tot}) and the displacement distribution functions (P(r,t)) averaged over all colloids of different sizes do not show anomalous and glassy dynamic behaviors until the system volume fraction ϕ is increased up to 0.82. This indicates that the intrinsic polydispersity of bacterial cytoplasm should suppress the glass transition and help maintain the liquid state of the cytoplasm. On the other hand, colloids of each kind show totally different dynamic behaviors depending on their size. The dynamics of colloids of different size becomes non-Gaussian at a different range of ϕ, which suggests that a multistep glass transition should occur. The largest colloids undergo the glass transition at ϕ=0.65, while the glass transition does not occur for smaller colloids in our simulations even at the highest value of ϕ. We also investigate the distribution (P(θ,t)) of the relative angles of displacement for macromolecules and find that macromolecules undergo directionally correlated motions in a sufficiently dense system.

Nanoparticle production by UV irradiation of combustion generated soot particles

International Nuclear Information System (INIS)

Stipe, Christopher B.; Choi, Jong Hyun; Lucas, Donald; Koshland, Catherine P.; Sawyer, Robert F.

2004-01-01

Laser ablation of surfaces normally produce high temperature plasmas that are difficult to control. By irradiating small particles in the gas phase, we can better control the size and concentration of the resulting particles when different materials are photofragmented. Here, we irradiate soot with 193 nm light from an ArF excimer laser. Irradiating the original agglomerated particles at fluences ranging from 0.07 to 0.26 J/cm 2 with repetition rates of 20 and 100 Hz produces a large number of small, unagglomerated particles, and a smaller number of spherical agglomerated particles. Mean particle diameters from 20 to 50 nm are produced from soot originally having a mean electric mobility diameter of 265nm. We use a non-dimensional parameter, called the photon/atom ratio (PAR), to aid in understanding the photofragmentation process. This parameter is the ratio of the number of photons striking the soot particles to the number of the carbon atoms contained in the soot particles, and is a better metric than the laser fluence for analyzing laser-particle interactions. These results suggest that UV photofragmentation can be effective in controlling particle size and morphology, and can be a useful diagnostic for studying elements of the laser ablation process

Microwave-assisted in-situ regeneration of a perovskite coated diesel soot filter

NARCIS (Netherlands)

Zhang-Steenwinkel, Y.; van der Zande, L.M.; Castricum, H.L.; Bliek, A.; van den Brink, R.W.; Elzinga, G.D.

2005-01-01

Dielectric heating may be used as an in situ technique for the periodic regeneration of soot filters, as those used in Diesel engines. As generally the Diesel exhaust temperatures are below the soot light-off temperature, passive regeneration is not possible. Presently, we have investigated the

Viscosity and transient electric birefringence study of clay colloidal aggregation.

Science.gov (United States)

Bakk, Audun; Fossum, Jon O; da Silva, Geraldo J; Adland, Hans M; Mikkelsen, Arne; Elgsaeter, Arnljot

2002-02-01

We study a synthetic clay suspension of laponite at different particle and NaCl concentrations by measuring stationary shear viscosity and transient electrically induced birefringence (TEB). On one hand the viscosity data are consistent with the particles being spheres and the particles being associated with large amount bound water. On the other hand the viscosity data are also consistent with the particles being asymmetric, consistent with single laponite platelets associated with a very few monolayers of water. We analyze the TEB data by employing two different models of aggregate size (effective hydrodynamic radius) distribution: (1) bidisperse model and (2) log-normal distributed model. Both models fit, in the same manner, fairly well to the experimental TEB data and they indicate that the suspension consists of polydisperse particles. The models also appear to confirm that the aggregates increase in size vs increasing ionic strength. The smallest particles at low salt concentrations seem to be monomers and oligomers.

Dynamics of very small soot particles during soot burnout in diesel engines; Dynamik kleinster Russteilchen waehrend der Russausbrandphase im Dieselmotor

Energy Technology Data Exchange (ETDEWEB)

Bockhorn, H. [Karlsruhe Univ. (T.H.) (Germany). Inst. fuer Chemische Technik; Peters, N. [RWTH Aachen (DE). Institut fuer Technische Mechanik (ITM); Pittermann, R. [WTZ fuer Motoren- und Maschinenforschung Rosslau gGmbH (Germany); Hentschel, J.; Weber, J.

2003-07-01

The investigations used advanced laser-optical methods for measuring soot particle size distributions, temporally and spectrally resolved measurements of engine combustion, measurements of composition and size distribution of particles in exhaust, and further development and validation of reaction-kinetic models. In all, it can be stated that mixing will affect not only soot particle formation but also soot particle emissions. Mixing can be influenced by using a fuel-water emulsion and by CR injection. Experiments and models both showed the advantageous effects of water added to the diesel fuels and of CR injection. The higher OH radical concentrations in the later combustion stages also serve to ensure faster oxidation of soot. (orig.) [German] Ziel des Projektes war es, Informationen ueber die Bildung und Oxidation von Russ sowie die Teilchendynamik der Russteilchen waehrend der Ausbrandphase zu erhalten. Dies wurde erreicht durch die Weiterentwicklung laseroptischer Methoden zur Bestimmung der Groessenverteilung von Russpartikeln, durch zeit- und spektral aufgeloeste Erfassung der motorischen Verbrennung, durch die Bestimmung von Zusammensetzung und Groessenverteilung von Partikeln im Abgas sowie durch die Weiterentwicklung und Validierung von reaktionskinetischen Modellen. Zusammenfassend laesst sich sagen, dass sich die Gemischbildung im Dieselmotor nicht nur auf die Bildung der Russpartikel sondern auch auf die Russpartikelemission auswirkt. Die Verwendung einer Kraftstoff-Wasser-Emulsion und die Common-Rail-Einspritzung stellen zwei Verfahren zur Beeinflussung der Gemischbildung dar. Sowohl die experimentellen Untersuchungen als auch die Modellierung zeigen den die Gemischbildung foerdernden Einfluss des Zusatzes von Wasser zum Dieselbrennstoff. Ein erhoehter Anteil an vorgemischter Verbrennung, wie er auch durch die Verwendung hoher Einspritzdruecke bei der Common-Rail-Einspritzung erreicht werden kann, verringert die waehrend der Verbrennung entstehende

Thermal Radiation Effects on Thermal Explosion in Polydisperse Fuel Spray-Probabilistic Model

Directory of Open Access Journals (Sweden)

Ophir Navea

2011-06-01

Full Text Available We investigate the effect of thermal radiation on the dynamics of a thermal explosion of polydisperse fuel spray with a complete description of the chemistry via a single-step two-reactant model of general order. The polydisperse spray is modeled using a Probability Density Function (PDF. The thermal radiation energy exchange between the evaporation surface of the fuel droplets and the burning gas is described using the Marshak boundary conditions. An explicit expression of the critical condition for thermal explosion limit is derived analytically and represents a generalization of the critical parameter of the classical Semenov theory. Because we investigated the model in the range where the temperature is very high, the effect of the thermal radiation is significant.

Sources and burial fluxes of soot black carbon in sediments on the Mackenzie, Chukchi, and Bering Shelves

Science.gov (United States)

Yang, Weifeng; Guo, Laodong

2018-03-01

Black carbon (BC) has been recognized as a climate forcing and a major component in the global carbon budget. However, studies on BC in the Arctic Ocean remain scarce. We report here variations in the abundance, sources and burial fluxes of sedimentary soot black carbon (soot-BC) in the western Arctic Ocean. The soot-BC contents averaged 1.6 ± 0.3, 0.46 ± 0.04 and 0.56 ± 0.10 mg-C g-1 on the Mackenzie, Chukchi and Bering Shelves, respectively, accounting for 16.6%, 10.2% and 10.4% of the total organic carbon in surface sediment. Temporally, contents of soot-BC remained fairly stable before 1910, but increased rapidly after the 1970s on the Mackenzie Shelf, indicating enhanced source input related to warming. Comparable δ13C signatures of soot-BC (- 24.95‰ to - 24.57‰) to C3 plants pointed to a major biomass source of soot-BC to the Beaufort Sea. Soot-BC showed similar temporal patterns with large fluctuations in the Chukchi/Bering shelf regions, implying the same source terms for soot-BC in these areas. Two events with elevated soot-BC corresponded to a simultaneous increase in biomass combustion and fossil fuel (coal and oil) consumption in Asia. The similar temporal variability in sedimentary soot-BC between the Arctic shelves and Asian lakes and the comparable δ13C values manifested that anthropogenic emission from East Asia was an important source of soot-BC in the western Arctic and subarctic regions. The burial fluxes of soot-BC, estimated from both 137Cs- and 210Pb-derived sedimentation rates, were 2.43 ± 0.42 g-C m-2 yr-1 on the Mackenzie Shelf, representing an efficient soot-BC sink. Soot-BC showed an increase in buried fluxes from 0.56 ± 0.02 g-C m-2 yr-1 during 1963-1986 to 0.88 ± 0.05 g-C m-2 yr-1 after 1986 on the Chukchi Shelf, and from 1.00 ± 0.18 g-C m-2 yr-1 to 2.58 ± 1.70 g-C m-2 yr-1 on the Bering Shelf, which were consistent with recent anthropogenically enhanced BC input observed especially in Asia. Overall, the three Arctic

Evaluation and optimisation of phenomenological multi-step soot model for spray combustion under diesel engine-like operating conditions

Science.gov (United States)

Pang, Kar Mun; Jangi, Mehdi; Bai, Xue-Song; Schramm, Jesper

2015-05-01

In this work, a two-dimensional computational fluid dynamics study is reported of an n-heptane combustion event and the associated soot formation process in a constant volume combustion chamber. The key interest here is to evaluate the sensitivity of the chemical kinetics and submodels of a semi-empirical soot model in predicting the associated events. Numerical computation is performed using an open-source code and a chemistry coordinate mapping approach is used to expedite the calculation. A library consisting of various phenomenological multi-step soot models is constructed and integrated with the spray combustion solver. Prior to the soot modelling, combustion simulations are carried out. Numerical results show that the ignition delay times and lift-off lengths exhibit good agreement with the experimental measurements across a wide range of operating conditions, apart from those in the cases with ambient temperature lower than 850 K. The variation of the soot precursor production with respect to the change of ambient oxygen levels qualitatively agrees with that of the conceptual models when the skeletal n-heptane mechanism is integrated with a reduced pyrene chemistry. Subsequently, a comprehensive sensitivity analysis is carried out to appraise the existing soot formation and oxidation submodels. It is revealed that the soot formation is captured when the surface growth rate is calculated using a square root function of the soot specific surface area and when a pressure-dependent model constant is considered. An optimised soot model is then proposed based on the knowledge gained through this exercise. With the implementation of optimised model, the simulated soot onset and transport phenomena before reaching quasi-steady state agree reasonably well with the experimental observation. Also, variation of spatial soot distribution and soot mass produced at oxygen molar fractions ranging from 10.0 to 21.0% for both low and high density conditions are reproduced.

Cloud condensation nuclei and ice nucleation activity of hydrophobic and hydrophilic soot particles.

Science.gov (United States)

Koehler, Kirsten A; DeMott, Paul J; Kreidenweis, Sonia M; Popovicheva, Olga B; Petters, Markus D; Carrico, Christian M; Kireeva, Elena D; Khokhlova, Tatiana D; Shonija, Natalia K

2009-09-28

Cloud condensation nuclei (CCN) activity and ice nucleation behavior (for temperaturesnucleation experiments below -40 degrees C, AEC particles nucleated ice near the expected condition for homogeneous freezing of water from aqueous solutions. In contrast, GTS, TS, and TC1 required relative humidity well in excess of water saturation at -40 degrees C for ice formation. GTS particles required water supersaturation conditions for ice activation even at -51 degrees C. At -51 to -57 degrees C, ice formation in particles with electrical mobility diameter of 200 nm occurred in up to 1 in 1000 TS and TC1 particles, and 1 in 100 TOS particles, at relative humidities below those required for homogeneous freezing in aqueous solutions. Our results suggest that heterogeneous ice nucleation is favored in cirrus conditions on oxidized hydrophilic soot of intermediate polarity. Simple considerations suggest that the impact of hydrophilic soot particles on cirrus cloud formation would be most likely in regions of elevated atmospheric soot number concentrations. The ice formation properties of AEC soot are reasonably consistent with present understanding of the conditions required for aircraft contrail formation and the proportion of soot expected to nucleate under such conditions.

Quantitative effects of rapid heating on soot-particle sizing through analysis of two-pulse LII

KAUST Repository

Cenker, Emre

2017-02-27

During the rapid laser pulse heating and consecutive cooling in laser-induced incandescence (LII), soot particles may undergo thermal annealing and sublimation processes which lead to a permanent change in its optical properties and its primary particle size, respectively. Overall, effects of these two processes on soot and LII model-based particle sizing are investigated by measuring the two-color time-resolved (2C-TiRe) LII signal decay from in-flame soot after two consecutive laser pulses at 1064-nm wavelength. Experiments are carried out on a non-premixed laminar ethylene/air flame from a Santoro burner with both low and moderate laser fluences suitable for particle sizing. The probe volume is set to a radial position close to the flame axis where the soot particles are known to be immature or less graphitic. With the first pulse, soot is pre-heated, and the LII signal after the consecutive second pulse is used for analysis. The two-color incandescence emission technique is used for the pyrometric determination of the LII-heated peak soot temperature at the second pulse. A new LII simulation tool is developed which accounts for particle heating via absorption and annealing, and cooling via sublimation, conduction, and radiation with various existing sub-models from the literature. The same approach of using two laser pulses is implemented in the simulations. Measurements indicate that thermal annealing and associated absorption enhancement becomes important at laser fluences above 0.17 J/cm2 for the immature in-flame soot. After a heating pulse at 0.33 J/cm2, the increase of the soot absorption function is calculated as 35% using the temperature measured at the second pulse and an absorption model based on the Rayleigh approximation. Present annealing model, on the other hand, predicts graphitization of soot even in the absence of laser heating at typical flame temperatures. Recorded experimental LII signal decays and LII-heated peak soot temperature

Single Particle Soot Photometer intercomparison at the AIDA chamber

Directory of Open Access Journals (Sweden)

M. Laborde

2012-12-01

Full Text Available Soot particles, consisting of black carbon (BC, organic carbon (OC, inorganic salts, and trace elements, are emitted into the atmosphere during incomplete combustion. Accurate measurements of atmospheric BC are important as BC particles cause adverse health effects and impact the climate.

Unfortunately, the accurate measurement of the properties and mass concentrations of BC particles remains difficult. The Single Particle Soot Photometer (SP2 can contribute to improving this situation by measuring the mass of refractory BC in individual particles as well as its mixing state.

Here, the results of the first detailed SP2 intercomparison, involving 6 SP2s from 6 different research groups, are presented, including the most evolved data products that can presently be calculated from SP2 measurements.

It was shown that a detection efficiency of almost 100% down to 1 fg BC per particle can readily be achieved, and that this limit can be pushed down to ∼0.2 fg BC with optimal SP2 setup. Number and mass size distributions of BC cores agreed within ±5% and ±10%, respectively, in between the SP2s, with larger deviations in the range below 1 fg BC.

The accuracy of the SP2's mass concentration measurement depends on the calibration material chosen. The SP2 has previously been shown to be equally sensitive to fullerene soot and ambient BC from sources where fossil fuel was dominant and less sensitive to fullerene soot than to Aquadag. Fullerene soot was therefore chosen as the standard calibration material by the SP2 user community; however, many data sets rely solely on Aquadag calibration measurements. The difference in SP2 sensitivity was found to be almost equal (fullerene soot to Aquadag response ratio of ∼0.75 at 8.9 fg BC for all SP2s. This allows the calculation of a fullerene soot equivalent calibration curve from a measured Aquadag calibration, when no fullerene soot calibration is available. It could be

Two-dimensional quantification of soot and flame-soot interaction in spray combustion at elevated pressures - Final report

Energy Technology Data Exchange (ETDEWEB)

Gerber, T.

2008-07-15

Single-pulse time-resolved laser-induced incandescence (TiRe-LII) signal transients from soot particulates were acquired during unsteady high pressure Diesel combustion in a constant volume cell near top dead centre conditions typically found in a Diesel engine. Measurements were performed for initial gas pressures between 1 MPa and 3 MPa, injection pressures between 50 MPa and 130 MPa and laser probe timings between 5 ms and 16 ms after start of fuel injection. In separate experiments and for the same cell operating conditions, gas temperatures were deduced from spectrally resolved soot pyrometry measurements. Implementing the LII model of Kock et al. ensemble mean soot particle diameters were evaluated from least-squares fitting of theoretical cooling curves to experimental TiRe-LII signal transients. Since in the experiments the environmental gas temperature and the width of an assumed particle size distribution were not known, the effects of the initial choice of these parameters on retrieved particle diameters were investigated. It is shown that evaluated mean particle diameters are only slightly biased by the choice of typical size distribution widths and gas temperatures. For a fixed combustion phase mean particle diameters are not much affected by gas pressure, however they become smaller at high fuel injection pressure. At a mean chamber pressure of 1.4 MPa evaluated mean particle diameters increased by a factor of two for probe delays between 5 ms and 16 ms after start of injection, irrespective of the choices of first-guess fitting variables, indicating a certain robustness of data analysis procedure. (author)

Soot and radiation in combusting boundary layers

Energy Technology Data Exchange (ETDEWEB)

Beier, R.A.

1981-12-01

In most fires thermal radiation is the dominant mode of heat transfer. Carbon particles within the fire are responsible for most of this emitted radiation and hence warrant quantification. As a first step toward understanding thermal radiation in full scale fires, an experimental and theoretical study is presented for a laminar combusting boundary layer. Carbon particulate volume fraction profiles and approximate particle size distributions are experimentally determined in both free and forced flow for several hydrocarbon fuels and PMMA (polymethylmethacrylate). A multiwavelength laser transmission technique determines a most probable radius and a total particle concentration which are two unknown parameters in an assumed Gauss size distribution. A sooting region is observed on the fuel rich side of the main reaction zone. For free flow, all the flames are in air, but the free stream ambient oxygen mass fraction is a variable in forced flow. To study the effects of radiation heat transfer, a model is developed for a laminar combusting boundary layer over a pyrolyzing fuel surface. An optically thin approximation simplifies the calculation of the radiant energy flux at the fuel surface. For the free flames in air, the liquid fuel soot volume fractions, f/sub v/, range from f/sub v/ approx. 10/sup -7/ for n-heptane, a paraffin, to f/sub v/ approx. 10/sup -7/ for toluene, an aromatic. The PMMA soot volume fractions, f/sub v/ approx. 5 x 10/sup -7/, are approximately the same as the values previously reported for pool fires. Soot volume fraction increases monotonically with ambient oxygen mass fraction in the forced flow flames. For all fuels tested, a most probable radius between 20 nm and 80 nm is obtained which varies only slightly with oxygen mass fraction, streamwise position, or distance normal to the fuel surface. The theoretical analysis yields nine dimensionless parameters, which control the mass flux rate at the pyrolyzing fuel surface.

Simultaneous measurements of acetylene and soot during the pyrolysis of ethylene and benzene in a shock tube

KAUST Repository

KC, Utsav

2016-10-12

Acetylene is one of the most important precursors of soot and contributes to soot growth by the hydrogen-abstraction acetylene-addition (HACA) mechanism. In this work, we undertake time-resolved simultaneous measurements of acetylene and soot behind reflected shock waves at temperatures of 1600-2200. K and pressures of 3-5. bar. Acetylene mole fraction time-histories are measured from the absorption of a quantum-cascade laser operating around 13.6. μm. The soot volume fraction, particle size and number densities are calculated from the extinction and scattering of a cw Nd:Yag laser at 532. nm. Acetylene and soot are generated from the pyrolysis of 1% benzene in argon, 2.35% ethylene in argon, and binary mixtures of ethylene with propane/methane in argon. We note that acetylene time-histories exhibit a two-stage growth during the pyrolysis of benzene, which can be correlated to the initial rapid increase of soot volume fraction and a later plateauing. In comparison to ethylene pyrolysis, the pyrolysis of benzene results in larger values of the soot volume fraction, particle diameter and number density. We compare the measured data against the values simulated using the method-of-moments routine in Chemkin-Pro and a detailed PAH mechanism based on KM2 [1] and AramcoMech 1.3 [2]. Large discrepancies are observed between the measured and predicted values of the soot parameters. The data obtained from our experiments may assist future validation and development of soot mechanisms.

Effects of compositional heterogeneity and nanoporosity of raw and treated biomass-generated soot on adsorption and absorption of organic contaminants

International Nuclear Information System (INIS)

Chen Baoliang; Huang Wenhai

2011-01-01

A biomass-generated soot was sequentially treated by HCl-HF solution, organic solvent, and oxidative acid to remove ash, extractable native organic matter (EOM), and amorphous carbon. The compositional heterogeneity and nano-structure of the untreated and treated soot samples were characterized by elemental analysis, thermal gravimetric analysis, BET-N 2 surface area, and electron microscopic analysis. Sorption properties of polar and nonpolar organic pollutants onto the soot samples were compared, and individual contributions of adsorption and absorption were quantified. The sorption isotherms for raw sample were practically linear, while were nonlinear for the pretreated-soot. The removal of EOM enhanced adsorption and reduced absorption, indicating that EOM served as a partitioning phase and simultaneously masked the adsorptive sites. By drastic-oxidation, the outer amorphous carbon and the inner disordered core of the soot particles were completely removed, and a fullerene-like nanoporous structure (aromatic shell) was created, which promoted additional π-π interaction between phenanthrene and the soot. - Graphical abstract: The dual sorptive nature of the biomass-generated soot, i.e., the adsorptive effect of the carbonized soot fraction and the partition effect of the amorphous soot component. Research highlights: → The biomass-generated soot owns the heterogeneous compositions and nano-structures. → The soot exhibits the dual sorptive nature, i.e., adsorption and absorption. → Removal of the amorphous component weakens absorption, but strengthens adsorption. → The exposed adsorptive sites with highly aromatic nature promotes π-π interaction. → The dual sorptive nature of the soot depends on the various soot components. - The compositional heterogeneity and nano-structure play a regulating role in the adsorption and absorption of organic contaminants with the untreated and treated soot samples.

Particulate matter emission modelling based on soot and SOF from direct injection diesel engines

International Nuclear Information System (INIS)

Tan, P.Q.; Hu, Z.Y.; Deng, K.Y.; Lu, J.X.; Lou, D.M.; Wan, G.

2007-01-01

Particulate matter (PM) emission is one of the major pollutants from diesel engines, and it is harmful for human health and influences the atmospheric visibility. In investigations for reducing PM emission, a simulation model for PM emission is a useful tool. In this paper, a phenomenological, composition based PM model of direct injection (DI) diesel engines has been proposed and formulated to simulate PM emission. The PM emission model is based on a quasi-dimensional multi-zone combustion model using the formation mechanisms of the two main compositions of PM: soot and soluble organic fraction (SOF). First, the quasi-dimensional multi-zone combustion model is given. Then, two models for soot and SOF emissions are established, respectively, and after that, the two models are integrated into a single PM emission model. The soot emission model is given by the difference between a primary formation model and an oxidation model of soot. The soot primary formation model is the Hiroyasu soot formation model, and the Nagle and Strickland-Constable model is adopted for soot oxidation. The SOF emission model is based on an unburned hydrocarbons (HC) emission model, and the HC emission model is given by the difference between a HC primary formation model and a HC oxidation model. The HC primary formation model considers fuel injected and mixed beyond the lean combustion limit during ignition delay and fuel effusing from the nozzle sac volume at low pressure and low velocity. In order to validate the PM emission model, experiments were performed on a six cylinder, turbocharged and intercooled DI diesel engine. The simulation results show good agreement with the experimental data, which indicates the validity of the PM emission model. The calculation results show that the distinctions between PM and soot formation rates are mainly in the early combustion stage. The SOF formation has an important influence on the PM formation at lower loads, and soot formation dominates the

Oxidation of diesel soot on binary oxide CuCr(Co)-based monoliths.

Science.gov (United States)

Soloviev, Sergiy O; Kapran, Andriy Y; Kurylets, Yaroslava P

2015-02-01

Binary oxide systems (CuCr2O4, CuCo2O4), deposited onto cordierite monoliths of honeycomb structure with a second support (finely dispersed Al2O3), were prepared as filters for catalytic combustion of diesel soot using internal combustion engine's gas exhausts (O2, NOx, H2O, CO2) and O3 as oxidizing agents. It is shown that the second support increases soot capacity of aforementioned filters, and causes dispersion of the particles of spinel phases as active components enhancing thereby catalyst activity and selectivity of soot combustion to CO2. Oxidants used can be arranged with reference to decreasing their activity in a following series: O3≫NO2>H2O>NO>O2>CO2. Ozone proved to be the most efficient oxidizing agent: the diesel soot combustion by O3 occurs intensively (in the presence of copper chromite based catalyst) even at closing to ambient temperatures. Results obtained give a basis for the conclusion that using a catalytic coating on soot filters in the form of aforementioned binary oxide systems and ozone as the initiator of the oxidation processes is a promising approach in solving the problem of comprehensive purification of automotive exhaust gases at relatively low temperatures, known as the "cold start" problem. Copyright © 2014. Published by Elsevier B.V.

Development of high fidelity soot aerosol dynamics models using method of moments with interpolative closure

KAUST Repository

Roy, Subrata P.

2014-01-28

The method of moments with interpolative closure (MOMIC) for soot formation and growth provides a detailed modeling framework maintaining a good balance in generality, accuracy, robustness, and computational efficiency. This study presents several computational issues in the development and implementation of the MOMIC-based soot modeling for direct numerical simulations (DNS). The issues of concern include a wide dynamic range of numbers, choice of normalization, high effective Schmidt number of soot particles, and realizability of the soot particle size distribution function (PSDF). These problems are not unique to DNS, but they are often exacerbated by the high-order numerical schemes used in DNS. Four specific issues are discussed in this article: the treatment of soot diffusion, choice of interpolation scheme for MOMIC, an approach to deal with strongly oxidizing environments, and realizability of the PSDF. General, robust, and stable approaches are sought to address these issues, minimizing the use of ad hoc treatments such as clipping. The solutions proposed and demonstrated here are being applied to generate new physical insight into complex turbulence-chemistry-soot-radiation interactions in turbulent reacting flows using DNS. © 2014 Copyright Taylor and Francis Group, LLC.

Archean Earth Atmosphere Fractal Haze Aggregates: Light Scattering Calculations and the Faint Young Sun Paradox

Science.gov (United States)

Boness, D. A.; Terrell-Martinez, B.

2010-12-01

As part of an ongoing undergraduate research project of light scattering calculations involving fractal carbonaceous soot aggregates relevant to current anthropogenic and natural sources in Earth's atmosphere, we have read with interest a recent paper [E.T. Wolf and O.B Toon,Science 328, 1266 (2010)] claiming that the Faint Young Sun paradox discussed four decades ago by Carl Sagan and others can be resolved without invoking heavy CO2 concentrations as a greenhouse gas warming the early Earth enough to sustain liquid water and hence allow the origin of life. Wolf and Toon report that a Titan-like Archean Earth haze, with a fractal haze aggregate nature due to nitrogen-methane photochemistry at high altitudes, should block enough UV light to protect the warming greenhouse gas NH3 while allowing enough visible light to reach the surface of the Earth. To test this hypothesis, we have employed a rigorous T-Matrix arbitrary-particle light scattering technique, to avoid the simplifications inherent in Mie-sphere scattering, on haze fractal aggregates at UV and visible wavelenths of incident light. We generate these model aggregates using diffusion-limited cluster aggregation (DLCA) algorithms, which much more closely fit actual haze fractal aggregates than do diffusion-limited aggregation (DLA) algorithms.

Ultra-small-angle X-ray scattering characterization of diesel/gasoline soot: sizes and particle-packing conditions

Science.gov (United States)

Kameya, Yuki; Lee, Kyeong O.

2013-10-01

Regulations on particulate emissions from internal combustion engines tend to become more stringent, accordingly the importance of particulate filters in the after-treatment system has been increasing. In this work, the applicability of ultra-small-angle X-ray scattering (USAXS) to diesel soot cake and gasoline soot was investigated. Gasoline-direct-injection engine soot was collected at different fuel injection timings. The unified fits method was applied to analyze the resultant scattering curves. The validity of analysis was supported by comparing with carbon black and taking the sample images using a transmission electron microscope, which revealed that the primary particle size ranged from 20 to 55 nm. In addition, the effects of particle-packing conditions on the USAXS measurement were demonstrated by using samples suspended in acetone. Then, the investigation was extended to characterization of diesel soot cake deposited on a diesel particulate filter (DPF). Diesel soot was trapped on a small piece of DPF at different deposition conditions which were specified using the Peclet number. The dependence of scattering curve on soot-deposition conditions was demonstrated. To support the interpretation of the USAXS results, soot cake samples were observed using a scanning electron microscope and the influence of particle-packing conditions on scattering curve was discussed.

Ultra-small-angle X-ray scattering characterization of diesel/gasoline soot: sizes and particle-packing conditions

International Nuclear Information System (INIS)

Kameya, Yuki; Lee, Kyeong O.

2013-01-01

Regulations on particulate emissions from internal combustion engines tend to become more stringent, accordingly the importance of particulate filters in the after-treatment system has been increasing. In this work, the applicability of ultra-small-angle X-ray scattering (USAXS) to diesel soot cake and gasoline soot was investigated. Gasoline-direct-injection engine soot was collected at different fuel injection timings. The unified fits method was applied to analyze the resultant scattering curves. The validity of analysis was supported by comparing with carbon black and taking the sample images using a transmission electron microscope, which revealed that the primary particle size ranged from 20 to 55 nm. In addition, the effects of particle-packing conditions on the USAXS measurement were demonstrated by using samples suspended in acetone. Then, the investigation was extended to characterization of diesel soot cake deposited on a diesel particulate filter (DPF). Diesel soot was trapped on a small piece of DPF at different deposition conditions which were specified using the Peclet number. The dependence of scattering curve on soot-deposition conditions was demonstrated. To support the interpretation of the USAXS results, soot cake samples were observed using a scanning electron microscope and the influence of particle-packing conditions on scattering curve was discussed

Ultra-small-angle X-ray scattering characterization of diesel/gasoline soot: sizes and particle-packing conditions

Energy Technology Data Exchange (ETDEWEB)

Kameya, Yuki, E-mail: ykameya@anl.gov; Lee, Kyeong O. [Argonne National Laboratory, Center for Transportation Research (United States)

2013-10-15

Regulations on particulate emissions from internal combustion engines tend to become more stringent, accordingly the importance of particulate filters in the after-treatment system has been increasing. In this work, the applicability of ultra-small-angle X-ray scattering (USAXS) to diesel soot cake and gasoline soot was investigated. Gasoline-direct-injection engine soot was collected at different fuel injection timings. The unified fits method was applied to analyze the resultant scattering curves. The validity of analysis was supported by comparing with carbon black and taking the sample images using a transmission electron microscope, which revealed that the primary particle size ranged from 20 to 55 nm. In addition, the effects of particle-packing conditions on the USAXS measurement were demonstrated by using samples suspended in acetone. Then, the investigation was extended to characterization of diesel soot cake deposited on a diesel particulate filter (DPF). Diesel soot was trapped on a small piece of DPF at different deposition conditions which were specified using the Peclet number. The dependence of scattering curve on soot-deposition conditions was demonstrated. To support the interpretation of the USAXS results, soot cake samples were observed using a scanning electron microscope and the influence of particle-packing conditions on scattering curve was discussed.

Effect of exhaust gas recirculation (EGR) and multiple injections on diesel soot nano-structure and reactivity

International Nuclear Information System (INIS)

Rohani, Behzad; Bae, Choongsik

2017-01-01

Highlights: • EGR reduced the nano-structural order, regardless of injection strategy. • EGR reduces both VOF and reactivity, regardless of injection strategy. • Longer dwell time between pilot and main injection increases VOF and reactivity. • With EGR, VOF and reactivity are both reduced and un-affected by injection strategy. • VOF-reactivity correlation (without causality) suggests role of surface roughness. - Abstract: The physio-chemical characteristics of soot particles are of importance with regard to performance of diesel after-treatment systems. In this study, the soot particles generated in a single-cylinder heavy-duty diesel engine are examined in terms of nanostructure, oxidative reactivity and volatile organic fraction (VOF), using thermogravimetric analysis (TGA), X-ray diffraction (XRD), Raman micro-spectroscopy, and high resolution transmission electron microscopy (HRTEM). Five different injection strategies including single injection and multiple injections with various pilot injection amounts and dwell times were tested with and without exhaust gas recirculation (EGR), while combustion phasing, engine speed, and fuel injection quantity was matched for all cases. Results indicate that for the soot produced under EGR condition, nano-structural order (indicated by crystallite size obtained from XRD and AD1/AG resulted from the Raman Analysis) can explain the soot reactivity. However, in the absence of EGR, the reactivity trend cannot be explained by the structural order. It is discussed that a possible reason can be a higher level of in-cylinder oxidation in non-EGR cases (indicated by higher level of surface functional groups) which roughens the soot surface, and enhances the oxidation by increasing the specific soot surface area. It is also found that in the absence of EGR, different injection strategies impact the soot reactivity and VOF content, which can be explained mainly through the level of charge premixed-ness and the in

Mobility and settling rate of agglomerates of polydisperse nanoparticles

Science.gov (United States)

Spyrogianni, Anastasia; Karadima, Katerina S.; Goudeli, Eirini; Mavrantzas, Vlasis G.; Pratsinis, Sotiris E.

2018-02-01

Agglomerate settling impacts nanotoxicology and nanomedicine as well as the stability of engineered nanofluids. Here, the mobility of nanostructured fractal-like SiO2 agglomerates in water is investigated and their settling rate in infinitely dilute suspensions is calculated by a Brownian dynamics algorithm tracking the agglomerate translational and rotational motion. The corresponding friction matrices are obtained using the HYDRO++ algorithm [J. G. de la Torre, G. del Rio Echenique, and A. Ortega, J. Phys. Chem. B 111, 955 (2007)] from the Kirkwood-Riseman theory accounting for hydrodynamic interactions of primary particles (PPs) through the Rotne-Prager-Yamakawa tensor, properly modified for polydisperse PPs. Agglomerates are generated by an event-driven method and have constant mass fractal dimension but varying PP size distribution, mass, and relative shape anisotropy. The calculated diffusion coefficient from HYDRO++ is used to obtain the agglomerate mobility diameter dm and is compared with that from scaling laws for fractal-like agglomerates. The ratio dm/dg of the mobility diameter to the gyration diameter of the agglomerate decreases with increasing relative shape anisotropy. For constant dm and mean dp, the agglomerate settling rate, us, increases with increasing PP geometric standard deviation σp,g (polydispersity). A linear relationship between us and agglomerate mass to dm ratio, m/dm, is revealed and attributed to the fast Brownian rotation of such small and light nanoparticle agglomerates. An analytical expression for the us of agglomerates consisting of polydisperse PPs is then derived, us=(1/-{ρf/ρp})g 3 π μ m/dm (ρf is the density of the fluid, ρp is the density of PPs, μ is the viscosity of the fluid, and g is the acceleration of gravity), valid for agglomerates for which the characteristic rotational time is considerably shorter than their settling time. Our calculations demonstrate that the commonly made assumption of monodisperse PPs

Soot Formation Modeling of n-dodecane and Diesel Sprays under Engine-Like Conditions

DEFF Research Database (Denmark)

Pang, Kar Mun; Poon, Hiew Mun; Ng, Hoon Kiat

2015-01-01

This work concerns the modelling of soot formation process in diesel spray combustion under engine-like conditions. The key aim is to investigate the soot formation characteristics at different ambient temperatures. Prior to simulating the diesel combustion, numerical models including a revised...

On transient climate change at the Cretaceous−Paleogene boundary due to atmospheric soot injections

Science.gov (United States)

Garcia, Rolando R.; Toon, Owen B.; Conley, Andrew J.

2017-01-01

Climate simulations that consider injection into the atmosphere of 15,000 Tg of soot, the amount estimated to be present at the Cretaceous−Paleogene boundary, produce what might have been one of the largest episodes of transient climate change in Earth history. The observed soot is believed to originate from global wildfires ignited after the impact of a 10-km-diameter asteroid on the Yucatán Peninsula 66 million y ago. Following injection into the atmosphere, the soot is heated by sunlight and lofted to great heights, resulting in a worldwide soot aerosol layer that lasts several years. As a result, little or no sunlight reaches the surface for over a year, such that photosynthesis is impossible and continents and oceans cool by as much as 28 °C and 11 °C, respectively. The absorption of light by the soot heats the upper atmosphere by hundreds of degrees. These high temperatures, together with a massive injection of water, which is a source of odd-hydrogen radicals, destroy the stratospheric ozone layer, such that Earth’s surface receives high doses of UV radiation for about a year once the soot clears, five years after the impact. Temperatures remain above freezing in the oceans, coastal areas, and parts of the Tropics, but photosynthesis is severely inhibited for the first 1 y to 2 y, and freezing temperatures persist at middle latitudes for 3 y to 4 y. Refugia from these effects would have been very limited. The transient climate perturbation ends abruptly as the stratosphere cools and becomes supersaturated, causing rapid dehydration that removes all remaining soot via wet deposition. PMID:28827324

Minor and Trace Element Chemistry of Urban NS-Soot from the Central Valley of CA, USA

Science.gov (United States)

Kleich, S. J.; Hooper, R.

2017-12-01

During a recent study of metal transport in the Central Valley of California, it was noted that ns-soot (soot) occurred as complex clusters of graphene-like spheres admixed with other aerosols and were usually the dominant component of PM2.5 air particulates. These soot clusters contained a wide variety of metals of environmental concern such as As,Pb,Cr, and Ni. This study reports semi-quantitative results for 20 minor and trace elements (calibrated with Smithsonian microbeam standards) using a 200kV Transmission Electron Microscope, EDS, and SAED. This study also examined the mineralogy and crystallinity of admixed aerosols within composite soot clusters. Samples selected represent three contrasting urban settings in the Central Valley: Woodland, on the western side of the valley (Interstate highway to the east); Stockton, an inland sea-port and land transportation corridor in the center of the valley; and Roseville, a major rail-transport hub to the east. The wet/dry Mediterranean climate of California resulted in pronounced seasonal variations in total metal content. Soot cluster chemistry is highly variable however certain patterns emerged. Soot collected during the wet season is generally more aciniform, less structurally complex, and had lower sulfur (sulfate) concentrations but still had significant levels of transition metals (V,Cr,Mn,Fe,Ni,Zn and Pb) . Dry season soot was predominantly admixed with sulfate aerosols, and enriched in alkalis and alkaline earth metals. Stockton (wet-season) soot had up to 6000ppm of Pb. There is appreciable Pb (210ppm-2600ppm) in 38% of samples from Roseville but no Pb greater than 200ppm in Woodland. The highest overall total metals were found in Roseville soot with appreciable As(670ppm), V(100ppm), Pb(2600ppm), Zn(4000 ppm), Cr(90ppm), and Ni(300ppm). Heavy transport (road/rail/port) correlates with higher metal contents regardless of climate.

The impact of carbon dioxide and exhaust gas recirculation on the oxidative reactivity of soot from ethylene flames and diesel engines

Science.gov (United States)

Al-Qurashi, Khalid O.

Restrictive emissions standards to reduce nitrogen oxides (NOx) and particulate matter (PM) emissions from diesel engines necessitate the development of advanced emission control technology. The engine manufacturers in the United States have implemented the exhaust gas recirculation (EGR) and diesel particulate filters (DPF) to meet the stringent emissions limits on NOx and PM, respectively. Although the EGR-DPF system is an effective means to control diesel engine emissions, there are some concerns associated with its implementation. The chief concern with this system is the DPF regenerability, which depends upon several factors, among which are the physicochemical properties of the soot. Despite the plethora of research that has been conducted on DPF regenerability, the impact of EGR on soot reactivity and DPF regenerability is yet to be examined. This work concerns the impact of EGR on the oxidative reactivity of diesel soot. It is part of ongoing research to bridge the gap in establishing a relationship between soot formation conditions, properties, and reactivity. This work is divided into three phases. In the first phase, carbon dioxide (CO2) was added to the intake charge of a single cylinder engine via cylinders of compressed CO2. This approach simulates the cold-particle-free EGR. The results showed that inclusion of CO2 changes the soot properties and yields synergistic effects on the oxidative reactivity of the resulting soot. The second phase of this research was motivated by the findings from the first phase. In this phase, post-flame ethylene soot was produced from a laboratory co-flow laminar diffusion flame to better understand the mechanism by which the CO2 affects soot reactivity. This phase was accomplished by successfully isolating the dilution, thermal, and chemical effects of the CO2. The results showed that all of these effects account for a measurable increase in soot reactivity. Nevertheless, the thermal effect was found to be the most

Soot blowing methods and soot steam consumption in Swedish recovery boilers; Sotningsmetoder och sotaangfoerbrukning i svenska sodapannor

Energy Technology Data Exchange (ETDEWEB)

Svedin, Kristoffer; Wallin, Erik; Ahlroth, Mikael

2008-09-15

The aim with the report was to put together a description of the current state of the sootblowing systems at Swedish recovery boilers, and to explain differences in cleanability and sootblowing efficiency. In chapter 4 a summary of new techniques and alternative soot blowing methods is found. The report is intended for persons working in the pulp industry. To facilitate the benchmarking the recovery boilers have been divided into two groups. Group A comprises recovery boilers which only have one stop per year and the remaining recovery boilers with more than one stop are classified into group B. The following conclusions, based on the recovery boiler design specifications, are of importance to achieve high boiler availability: Low furnace load; High recovery boiler, wide furnace bottom area; Modern air ports; Small or no correlation between cross pitch division in heat surfaces and cleanability could be seen. The expectation was to identify such a relation. However there are doubts on the correctness in reported data. The amount of chlorine and potassium is assumed to affect the cleanability for a few recovery boilers, but for the majority the amounts are low and most likely do not impact the operation. Because of the large impact of the recovery boilers design data (furnace area, load etc.) on the sootblowing, it has been hard to identify the relation cleanability contra sootblowing system. The relations that could be seen are: No distinction between normally designed nozzles and 'high efficiency' nozzles could be identified. The operational conditions for the different models differ a lot and the effect of nozzle type could not be distinguished. Only a minority of the soot blowing sequences are known from the study. In the recovery boilers with problematic areas improvements can be made in the soot blowing sequence. Four recovery boilers are using intelligent soot blowing of some kind. Two of these boilers have low availability and the other two have

Soot and Spectral Radiation Modeling in ECN Spray A and in Engines

Energy Technology Data Exchange (ETDEWEB)

Haworth, Daniel C [Pennsylvania State Univ., University Park, PA (United States); Ferreyro-Fernandez, Sebastian [Pennsylvania State Univ., University Park, PA (United States); Paul, Chandan [Pennsylvania State Univ., University Park, PA (United States); Sircar, Arpan [Pennsylvania State Univ., University Park, PA (United States); Imren, Abdurrahman [Pennsylvania State Univ., University Park, PA (United States); Roy, Somesh P [Marquette University (United States); Modest, Michael F [University of California Merced (United States); Ge, Wenjun [University of California Merced (United States)

2017-04-03

The amount of soot formed in a turbulent combustion system is determined by a complex system of coupled nonlinear chemical and physical processes. Different physical subprocesses can dominate, depending on the hydrodynamic and thermochemical environments. Similarly, the relative importance of reabsorption, spectral radiation properties, and molecular gas radiation versus soot radiation varies with thermochemical conditions, and in ways that are difficult to predict for the highly nonhomogeneous in-cylinder mixtures in engines. Here it is shown that transport and mixing play relatively more important roles as rate-determining processes in soot formation at engine-relevant conditions. It is also shown that molecular gas radiation and spectral radiation properties are important for engine-relevant conditions.

Effects of soot by-product from the synthesis of engineered metallofullerene nanomaterials on terrestrial invertebrates.

Science.gov (United States)

Johnson, David R; Boyd, Robert E; Bednar, Anthony J; Weiss, Charles A; Hull, Matt S; Coleman, Jessica G; Kennedy, Alan J; Banks, Cynthia J; Steevens, Jeffery A

2018-02-23

The synthesis of carbon-based nanomaterials is often inefficient, generating large amounts of soot with metals as waste by-product. Currently, there are no specific regulations for disposal of engineered nanomaterials or the waste by-products resulting from their synthesis, so it is presumed that by-products are disposed of in the same way as the parent (bulk) materials. We studied the terrestrial toxicity of soot from gadolinium metallofullerene nanomanufacturing on earthworms (Eisenia fetida) and isopods (Porcellio scaber). The metallofullerene soot consisted of carbon particle agglomerates in the nanometer and submicrometer ranges (1-100 and 101-999 nm, respectively), with metals used during nanomanufacturing detectable on the particles. Despite high metal concentrations (>100 000 mg/kg) in the soot, only a relatively small amount of metals leached out of a spiked field soil, suggesting only moderate mobility. Seven- and 14-d exposures in field soil demonstrated that the soot was only toxic to earthworms at high concentrations (>10 000 mg/kg); however, earthworms avoided spiked soils at lower concentrations (as low as 500 mg/kg) and at lower soil pH. The presence of soot in food and soil did not cause isopod avoidance. These data demonstrate that metallofullerene soot from nanomanufacturing may only be toxic to earthworms at high concentrations representative of improper disposal or accidental spills. However, our results indicate that terrestrial invertebrates may avoid soils contaminated with soot at sublethal concentrations. Environ Toxicol Chem 2018;9999:1-12. Published 2018 Wiley Periodicals, Inc. on behalf of SETAC. This article is a US government work, and as such, is in the public domain in the United States of America. Published 2018 Wiley Periodicals, Inc. on behalf of SETAC. This article is a US government work, and as such, is in the public domain in the United States of America.

Effect of Coatings on the Uptake Rate and HONO Yield in Heterogeneous Reaction of Soot with NO2

Science.gov (United States)

Cruz-Quiñones, M.; Khalizov, A. F.; Zhang, R.

2009-12-01

Heterogeneous reaction of nitrogen dioxide on carbon soot aerosols has been suggested as a possible source of nighttime nitrous acid (HONO) in atmosphere boundary layer. Available laboratory data show significant variability in the measured reaction probabilities and HONO yields, making it difficult to asses the atmospheric significance of this process. Moreover, little is known of how aging of soot aerosol through internal mixing with other atmospheric trace constituents will affect the heterogeneous reactivity and HONO production. In this work, the heterogeneous reaction of NO2 on fresh and aged soot films leading to HONO formation was studied through a series of kinetic uptake experiments and HONO yield measurements. Soot samples were prepared by incomplete combustion of propane and kerosene fuels under lean and rich flame conditions. Experiments were performed in a low-pressure, fast-flow reactor coupled to a chemical ionization mass spectrometer (CIMS), using atmospheric-level NO2 concentrations. Heterogeneous uptake coefficients, γ(geom) and γ(BET), were calculated using geometric and internal BET soot surface areas, respectively. The uptake coefficient and the HONO yield depend on the type of fuel and combustion regime and are the highest for soot samples prepared using rich kerosene flame. Although, the internal surface area of soot measured by BET method is a factor of 50 to 500 larger than the geometric surface area, only the top soot layers are involved in heterogeneous reaction with NO2 as follows from the observed weak dependence of γ(geom) and decrease in γ(BET) with increasing sample mass. Heating the soot samples before exposure to NO2 increases the BET surface area, the HONO yield, and the NO2 uptake coefficient due to the removal of the organic fraction from the soot backbone that unblocks active sites and makes them accessible for physical adsorption and chemical reactions. Our results support the oxidation-reduction mechanism involving

Validation of an LES Model for Soot Evolution against DNS Data in Turbulent Jet Flames

Science.gov (United States)

Mueller, Michael

2012-11-01

An integrated modeling approach for soot evolution in turbulent reacting flows is validated against three-dimensional Direct Numerical Simulation (DNS) data in a set of n-heptane nonpremixed temporal jet flames. As in the DNS study, the evolution of the soot population is described statistically with the Hybrid Method of Moments (HMOM). The oxidation of the fuel and formation of soot precursors are described with the Radiation Flamelet/Progress Variable (RFPV) model that includes an additional transport equation for Polycyclic Aromatic Hydrocarbons (PAH) to account for the slow chemistry governing these species. In addition, the small-scale interactions between soot, chemistry, and turbulence are described with a presumed subfilter PDF approach that accounts for the very large spatial intermittency characterizing soot in turbulent reacting flows. The DNS dataset includes flames at three different Damköhler numbers to study the influence of global mixing rates on the evolution of PAH and soot. In this work, the ability of the model to capture these trends quantitatively as Damköhler number varies is investigated. In order to reliably assess the LES approach, the LES is initialized from the filtered DNS data after an initial transitional period in an effort to minimize the hydrodynamic differences between the DNS and the LES.

Interactive graphical system for small-angle scattering analysis of polydisperse systems

International Nuclear Information System (INIS)

Konarev, P V; Volkov, V V; Svergun, D I

2016-01-01

A program suite for one-dimensional small-angle scattering analysis of polydisperse systems and multiple data sets is presented. The main program, POLYSAS , has a menu-driven graphical user interface calling computational modules from ATSAS package to perform data treatment and analysis. The graphical menu interface allows one to process multiple (time, concentration or temperature-dependent) data sets and interactively change the parameters for the data modelling using sliders. The graphical representation of the data is done via the Winteracter-based program SASPLOT . The package is designed for the analysis of polydisperse systems and mixtures, and permits one to obtain size distributions and evaluate the volume fractions of the components using linear and non-linear fitting algorithms as well as model-independent singular value decomposition. The use of the POLYSAS package is illustrated by the recent examples of its application to study concentration-dependent oligomeric states of proteins and time kinetics of polymer micelles for anticancer drug delivery. (paper)

A computational study of soot formation in opposed-flow diffusion flame interacting with vortices

KAUST Repository

Selvaraj, Prabhu; Im, Hong G.

2017-01-01

ethylene-air flame is simulated. A reduced mechanism with PAH pathways that includes until coronene and method of moments with interpolative closure (MOMIC) has been employed to calculate the soot characteristics. Interaction of sooting flame with a

A comparison of chemical structures of soot precursor nanoparticles from liquid fuel combustion in flames and engine

International Nuclear Information System (INIS)

Paul, Bireswar; Datta, Amitava; Datta, Aparna; Saha, Abhijit

2013-01-01

A comparative study of the chemical structures of soot precursor nanoparticles from the liquid fuel flame and engine exhaust has been performed in this work to establish an association between the particles from both the sources. Different ex-situ measurement techniques have been used to characterize the nanoparticles in samples collected from the laboratory petrol/air and iso-octane/air flames, as well as from a gasoline engine. The TEM images of the sampled material along with the EDS spectra corroborate the existence of carbonaceous nanoparticles. The nature of the UV absorption and fluorescence spectra of the samples from the iso-octane flame environment further confirms the sampled materials to be soot precursor nanoparticles. The DLS size distribution of the particles shows them to be below 10 nm size. FTIR spectrum of the precursor nanoparticles collected form the non-sooting zone of the flame and that of fully grown soot particles show few similarities and dissimilarities among them. The soot particles are found to be much more aromatized as compared to its precursor nanoparticles. The presence of carbonyl functional group (C=O) at around 1,720 cm −1 has been observed in soot precursor nanoparticles, while such oxygenated functional groups are not prominent in soot structure. The absorption (UV and IR) and fluorescence spectra of the carbonaceous material collected from the gasoline engine exhaust show many resemblances with those of soot precursor nanoparticles from flames. These spectroscopic resemblances of the soot precursor nanoparticles from the flame environment and engine exhaust gives the evidence that the in-cylinder combustion is the source of these particles in the engine exhaust.

Investigating the formation mechanism of soot-like materials present in blast furnace coke samples

Energy Technology Data Exchange (ETDEWEB)

S. Dong; P. A' lvarez; N. Paterson; D.R. Dugwell; R. Kandiyoti [Imperial College London, London (United Kingdom). Department of Chemical Engineering

2008-09-15

An attempt to gain an understanding of the formation mechanism of these 'soot-like' materials has been made by means of tracing the changes in the molecular-mass distribution and molecular structure of the NMP-extractable materials from an injectant coal as well as its partially gasified chars and its pyrolytic tars. Variations in the SEC chromatograms provide clues about changes in the apparent molecular-mass distributions of these NMP extracts. Results suggest that the build-up of 'soot-like' materials follows from the secondary reactions of tars evolved from the injectant coal. The likely secondary-reaction pathways have been probed by collating structural information on these NMP extracts. The time-resolved 13-16 and 22-25 min elution fractions from the SEC column have been characterized using UV fluorescence (UV F) spectroscopy. Greater concentrations of larger aromatic ring systems are found present in samples formed under conditions appearing more prone for soot formation. The 11-16 min (large apparent molecular mass) effluent from SEC has been examined by Fourier transform infrared (FTIR) spectroscopy and transmission electron microscopy (TEM). Results from FTIR spectroscopy are consistent with the UV F data, showing more significant extents of dehydrogenation under conditions more prone to form soot. Similarly, TEM results show that larger amount of graphene layers exist in samples exposed to more soot-prone conditions. The emerging picture for the formation of 'soot-like' materials involves a well-defined sequence. Tars evolved from the injectant coal undergo secondary dehydrogenation, condensation, and repolymerization reactions, which eventually lead to the formation of the NMP-extractable 'soot-like' materials of large apparent molecular mass. 44 refs., 7 figs., 3 tabs.

Characteristics of non-premixed oxygen-enhanced combustion: II. Flame structure effects on soot precursor kinetics resulting in soot-free flames

Energy Technology Data Exchange (ETDEWEB)

Skeen, S.A.; Axelbaum, R.L. [Department of Energy, Environmental, Chemical Engineering, Washington University in St. Louis, St. Louis, MO (United States); Yablonsky, G. [Department of Energy, Environmental, Chemical Engineering, Washington University in St. Louis, St. Louis, MO (United States); Parks College, Saint Louis University, St. Louis, MO (United States)

2010-09-15

A detailed computational study was performed to understand the effects of the flame structure on the formation and destruction of soot precursors during ethylene combustion. Using the USC Mech Version II mechanism the contributions of different pathways to the formation of benzene and phenyl were determined in a wide domain of Z{sub st} values via a reverse-pathway analysis. It was shown that for conventional ethylene-air flames two sequential reversible reactions play primary roles in the propargyl (C{sub 3}H{sub 3}) chemistry, namely (1) C{sub 2}H{sub 2}+CH{sub 3}= pC{sub 3} H{sub 4}+H, (2) pC{sub 3} H{sub 4}= C{sub 3} H{sub 3}+ H with the corresponding overall endothermic reaction of propargyl formation (3) C{sub 2} H{sub 2}+CH{sub 3}= C{sub 3} H{sub 3}+2H. The contributions of these reactions to propyne (pC{sub 3}H{sub 4}) and propargyl formation and propargyl self-combination leading to benzene and phenyl were studied as a function of physical position, temperature, Z{sub st}, and H concentration. In particular, the role of H radicals on soot precursor destruction was studied in detail. At low Z{sub st}, Reactions 1 and 2 contribute significantly to propyne and propargyl formation on the fuel side of the radical pool at temperatures greater than approx. 1600 K. At higher local temperatures near the radical pool where the concentration of H is significant, the reverse reactions begin to dominate resulting in soot precursor destruction. As Z{sub st} is increased, these regions merge and only net propargyl consumption is observed. Based on the equilibrium constant of Reaction 3, a Z{sub st} value was estimated above which the rate of propargyl formation as a soot precursor is greatly reduced (Z{sub st} = 0.3). This condition compares well with the experimental results for permanently blue counterflow flames in the literature. (author)

How to gain insight into the polydispersity of tannins: a combined MS and LC study.

Science.gov (United States)

Mouls, Laetitia; Hugouvieux, Virginie; Mazauric, Jean-Paul; Sommerer, Nicolas; Mazerolles, Gérard; Fulcrand, Hélène

2014-12-15

In the context of the potential health benefits of food polyphenols, the bioavailability of tannins (i.e. proanthocyanidins) is a major issue, which is strongly influenced by the polydispersity and the degree of polymerisation of tannins. The average degree of polymerisation (DP) of tannins is usually determined using depolymerisation methods, which do not provide any information about their polymer distribution. Moreover, it is still a challenge to characterise tannin fractions of high polydispersity and/or containing polymers of high molecular weights, due to the limit of detection of direct mass spectrometry (MS) analysis methods. In the present work, the polydispersity of several tannin fractions is investigated by two complementary methods: a MALDI-MS method and a semi-preparative sub-fractionation. Using a combination of these methods we are able to gain insight into the DP distributions of the fractions consisting of tannins of medium and high DP. Moreover combining analyses can be useful to assess and compare the DP distributions of most tannin fractions. Copyright © 2014 Elsevier Ltd. All rights reserved.

Lung clearance of polydispersed colloidal 198Au particles

International Nuclear Information System (INIS)

D'Addabbo, A.; Fanfani, G.

1975-01-01

Lung clearance was studied on a group of subjects over 65 years old and on subjects aged between 30 and 40. A slowing down of material deposited in the bronchial tubes (polydispersed colloidal 198 Au particles) was observed in the senile subjects. This phenomenon is apparently related not only to a reduced activity of the vibratile ciliae, in connection with the frequent metaplasia of the bronchial cylindrical epithelium, but also to a quantitative and qualitative change in the mucopolysaccharides forming the mucus secretion [fr

Modelling of boiling bubbly flows using a polydisperse approach

International Nuclear Information System (INIS)

Zaepffel, D.

2011-01-01

The objective of this work was to improve the modelling of boiling bubbly flows.We focused on the modelling of the polydisperse aspect of a bubble population, i.e. the fact that bubbles have different sizes and different velocities. The multi-size aspect of a bubble population can originate from various mechanisms. For the bubbly flows we are interested in, bubble coalescence, bubble break-up, phase change kinematics and/or gas compressibility inside the bubbles can be mentioned. Since, bubble velocity depends on bubble size, the bubble size spectrum also leads to a bubble velocity spectrum. An averaged model especially dedicated to dispersed flows is introduced in this thesis. Closure of averaged interphase transfer terms are written in a polydisperse framework, i.e. using a distribution function of the bubble sizes and velocities. A quadratic law and a cubic law are here proposed for the modelling of the size distribution function, whose evolution in space and time is then obtained with the use of the moment method. Our averaged model has been implemented in the NEPTUNE-CFD computation code in order to simulate the DEBORA experiment. The ability of our model to deal with sub-cooled boiling flows has therefore been evaluated. (author) [fr

Structural effects on the oxidation of soot particles by O2: Experimental and theoretical study

KAUST Repository

Raj, Abhijeet

2013-09-01

Soot particles are composed of polycyclic aromatic hydrocarbons (PAHs), which have either planar or curved structures. The oxidation behaviors of soot particles differ depending on their structures, arrangement of PAHs, and the type of surface functional groups. The oxidation rate of curved PAHs in soot is thought to be higher than that of planar ones. To understand the role that PAH structure plays in soot reactivity towards O2, experimental studies are conducted on two types of commercially produced soot, Printex-U and Fullerene soot, using high resolution transmission electron microscopy, electron energy loss spectroscopy, thermo-gravimetric analysis and elemental analysis. The relative concentrations of active sites, oxygenated functional groups, aliphatics and aromatics present in soots are evaluated. The activation energies for soot oxidation at different conversion levels are determined. The average activation energies of the two soots are found to differ by 26kJ/mol. To understand the reason for this difference, quantum calculations using density functional (B3LYP) and Hartree-Fock theories are conducted to study the reaction pathways of the oxidation by O2 of planar and curved PAHs using 4-pyrenyl and 1-corannulenyl as their model molecules, respectively. The energetically preferred channels for curved PAH oxidation differ from the planar one. The addition of O2 on a radical site of a six-membered ring to form a peroxyl radical is found to be barrierless for both the model PAHs. For peroxyl decomposition, three pathways are suggested, each of which involve the activation energies of 108, 170 and 121kJ/mol to form stable molecules in the case of planar PAH, and 94, 155 and 125kJ/mol in the case of curved PAH. During the oxidation of a five-membered ring, to form stable molecules, the activation energies of 90kJ/mol for the curved PAH and 169kJ/mol for the planar PAH relative to the energy of the peroxyl radical are required. The low activation barriers of

Polydisperse particle-driven gravity currents in non-rectangular cross section channels

Science.gov (United States)

Zemach, T.

2018-01-01

We consider a high-Reynolds-number gravity current generated by polydisperse suspension of n types of particles distributed in a fluid of density ρi. Each class of particles in suspension has a different settling velocity. The current propagates along a channel of non-rectangular cross section into an ambient fluid of constant density ρa. The bottom and top of the channel are at z = 0, H, and the cross section is given by the quite general form -f1(z) ≤ y ≤ f2(z) for 0 ≤ z ≤ H. The flow is modeled by the one-layer shallow-water equations obtained for the time-dependent motion. We solve the problem by a finite-difference numerical code to present typical height h, velocity u, and mass fractions of particle (concentrations) (ϕ( j), j = 1, …, n) profiles. The runout length of suspensions in channels of power-law cross sections is analytically predicted using a simplified depth-averaged "box" model. We demonstrate that any degree of polydispersivity adds to the runout length of the currents, relative to that of equivalent monodisperse currents with an average settling velocity. The theoretical predictions are supported by the available experimental data. The present approach is a significant generalization of the particle-driven gravity current problem: on the one hand, now the monodisperse current in non-rectangular channels is a particular case of n = 1. On the other hand, the classical formulation of polydisperse currents for a rectangular channel is now just a particular case, f(z) = const., in the wide domain of cross sections covered by this new model.

Simulation and analysis of the soot particle size distribution in a turbulent nonpremixed flame

KAUST Repository

Lucchesi, Marco; Abdelgadir, Ahmed Gamaleldin; Attili, Antonio; Bisetti, Fabrizio

2017-01-01

to the simulation of soot formation and growth in simplified configurations featuring a constant concentration of soot precursors and the evolution of the size distribution in time is found to depend on the intensity of the nucleation rate. Higher nucleation rates

Implications of the effective one-component analysis of pair correlations in colloidal fluids with polydispersity

Science.gov (United States)

Pond, Mark J.; Errington, Jeffrey R.; Truskett, Thomas M.

2011-09-01

Partial pair-correlation functions of colloidal suspensions with continuous polydispersity can be challenging to characterize from optical microscopy or computer simulation data due to inadequate sampling. As a result, it is common to adopt an effective one-component description of the structure that ignores the differences between particle types. Unfortunately, whether this kind of simplified description preserves or averages out information important for understanding the behavior of the fluid depends on the degree of polydispersity and can be difficult to assess, especially when the corresponding multicomponent description of the pair correlations is unavailable for comparison. Here, we present a computer simulation study that examines the implications of adopting an effective one-component structural description of a polydisperse fluid. The square-well model that we investigate mimics key aspects of the experimental behavior of suspended colloids with short-range, polymer-mediated attractions. To characterize the partial pair-correlation functions and thermodynamic excess entropy of this system, we introduce a Monte Carlo sampling strategy appropriate for fluids with a large number of pseudo-components. The data from our simulations at high particle concentrations, as well as exact theoretical results for dilute systems, show how qualitatively different trends between structural order and particle attractions emerge from the multicomponent and effective one-component treatments, even with systems characterized by moderate polydispersity. We examine consequences of these differences for excess-entropy based scalings of shear viscosity, and we discuss how use of the multicomponent treatment reveals similarities between the corresponding dynamic scaling behaviors of attractive colloids and liquid water that the effective one-component analysis does not capture.

Graph Theory and Ion and Molecular Aggregation in Aqueous Solutions

Science.gov (United States)

Choi, Jun-Ho; Lee, Hochan; Choi, Hyung Ran; Cho, Minhaeng

2018-04-01

In molecular and cellular biology, dissolved ions and molecules have decisive effects on chemical and biological reactions, conformational stabilities, and functions of small to large biomolecules. Despite major efforts, the current state of understanding of the effects of specific ions, osmolytes, and bioprotecting sugars on the structure and dynamics of water H-bonding networks and proteins is not yet satisfactory. Recently, to gain deeper insight into this subject, we studied various aggregation processes of ions and molecules in high-concentration salt, osmolyte, and sugar solutions with time-resolved vibrational spectroscopy and molecular dynamics simulation methods. It turns out that ions (or solute molecules) have a strong propensity to self-assemble into large and polydisperse aggregates that affect both local and long-range water H-bonding structures. In particular, we have shown that graph-theoretical approaches can be used to elucidate morphological characteristics of large aggregates in various aqueous salt, osmolyte, and sugar solutions. When ion and molecular aggregates in such aqueous solutions are treated as graphs, a variety of graph-theoretical properties, such as graph spectrum, degree distribution, clustering coefficient, minimum path length, and graph entropy, can be directly calculated by considering an ensemble of configurations taken from molecular dynamics trajectories. Here we show percolating behavior exhibited by ion and molecular aggregates upon increase in solute concentration in high solute concentrations and discuss compelling evidence of the isomorphic relation between percolation transitions of ion and molecular aggregates and water H-bonding networks. We anticipate that the combination of graph theory and molecular dynamics simulation methods will be of exceptional use in achieving a deeper understanding of the fundamental physical chemistry of dissolution and in describing the interplay between the self-aggregation of solute

Graph Theory and Ion and Molecular Aggregation in Aqueous Solutions.

Science.gov (United States)

Choi, Jun-Ho; Lee, Hochan; Choi, Hyung Ran; Cho, Minhaeng

2018-04-20

In molecular and cellular biology, dissolved ions and molecules have decisive effects on chemical and biological reactions, conformational stabilities, and functions of small to large biomolecules. Despite major efforts, the current state of understanding of the effects of specific ions, osmolytes, and bioprotecting sugars on the structure and dynamics of water H-bonding networks and proteins is not yet satisfactory. Recently, to gain deeper insight into this subject, we studied various aggregation processes of ions and molecules in high-concentration salt, osmolyte, and sugar solutions with time-resolved vibrational spectroscopy and molecular dynamics simulation methods. It turns out that ions (or solute molecules) have a strong propensity to self-assemble into large and polydisperse aggregates that affect both local and long-range water H-bonding structures. In particular, we have shown that graph-theoretical approaches can be used to elucidate morphological characteristics of large aggregates in various aqueous salt, osmolyte, and sugar solutions. When ion and molecular aggregates in such aqueous solutions are treated as graphs, a variety of graph-theoretical properties, such as graph spectrum, degree distribution, clustering coefficient, minimum path length, and graph entropy, can be directly calculated by considering an ensemble of configurations taken from molecular dynamics trajectories. Here we show percolating behavior exhibited by ion and molecular aggregates upon increase in solute concentration in high solute concentrations and discuss compelling evidence of the isomorphic relation between percolation transitions of ion and molecular aggregates and water H-bonding networks. We anticipate that the combination of graph theory and molecular dynamics simulation methods will be of exceptional use in achieving a deeper understanding of the fundamental physical chemistry of dissolution and in describing the interplay between the self-aggregation of solute

Morphological study of fluorescent carbon Nanoparticles (F-CNPs) from ground coffee waste soot oxidation by diluted acid

Science.gov (United States)

Gea, S.; Tjandra, S.; Joshua, J.; Wirjosentono, B.

2018-02-01

Coffee ground waste utilization for fluorescent carbon nanoparticles (F-CNPs) through soot oxidation with diluted HNO3 has been conducted. Soot was obtained through three different treatments to coffee ground waste; which was burned in furnaceat 550°C and 650°C and directly burned in a heat-proofcontainer. Then they were analyzed morphologically with Scanning Electron Microscope (SEM) instrument. Soot from direct burning indicated the optimum result where it has denser pores compared to other two soots. Soot obtained from direct burning was refluxed in diluted HNO3 for 12 hours to perform the oxidation. Yellowish brown supernatant was later observed which lead to green fluorescent under the UV light. F-CNPs characterization was done in Transmission Electron Microscopy, which showed that 7.4-23.4 nm of particle size were distributed.

Significant Climate Changes Caused by Soot Emitted From Rockets in the Stratosphere

Science.gov (United States)

Mills, M. J.; Ross, M.; Toohey, D. W.

2010-12-01

A new type of hydrocarbon rocket engine with a larger soot emission index than current kerosene rockets is expected to power a fleet of suborbital rockets for commercial and scientific purposes in coming decades. At projected launch rates, emissions from these rockets will create a persistent soot layer in the northern middle stratosphere that would disproportionally affect the Earth’s atmosphere and cryosphere. A global climate model predicts that thermal forcing in the rocket soot layer will cause significant changes in the global atmospheric circulation and distributions of ozone and temperature. Tropical ozone columns decline as much as 1%, while polar ozone columns increase by up to 6%. Polar surface temperatures rise one Kelvin regionally and polar summer sea ice fractions shrink between 5 - 15%. After 20 years of suborbital rocket fleet operation, globally averaged radiative forcing (RF) from rocket soot exceeds the RF from rocket CO_{2} by six orders of magnitude, but remains small, comparable to the global RF from aviation. The response of the climate system is surprising given the small forcing, and should be investigated further with different climate models.

Efficient low-temperature soot combustion by bimetallic Ag-Cu/SBA-15 catalysts.

Science.gov (United States)

Wen, Zhaojun; Duan, Xinping; Hu, Menglin; Cao, Yanning; Ye, Linmin; Jiang, Lilong; Yuan, Youzhu

2018-02-01

In this study, the effects of copper (Cu) additive on the catalytic performance of Ag/SBA-15 in complete soot combustion were investigated. The soot combustion performance of bimetallic Ag-Cu/SBA-15 catalysts was higher than that of monometallic Ag and Cu catalysts. The optimum catalytic performance was acquired with the 5Ag 1 -Cu 0.1 /SBA-15 catalyst, on which the soot combustion starts at T ig =225°C with a T 50 =285°C. The temperature for 50% of soot combustion was lower than that of conventional Ag-based catalysts to more than 50°C (Aneggi et al., 2009). Physicochemical characterizations of the catalysts indicated that addition of Cu into Ag could form smaller bimetallic Ag-Cu nanolloy particles, downsizing the mean particle size from 3.7nm in monometallic catalyst to 2.6nm in bimetallic Ag-Cu catalyst. Further experiments revealed that Ag and Cu species elicited synergistic effects, subsequently increasing the content of surface active oxygen species. As a result, the structure modifications of Ag by the addition of Cu strongly intensified the catalytic performance. Copyright © 2017. Published by Elsevier B.V.

The effect of ethanol blending on mixture formation, combustion and soot emission studied in an optical DISI engine

International Nuclear Information System (INIS)

Storch, Michael; Hinrichsen, Florian; Wensing, Michael; Will, Stefan; Zigan, Lars

2015-01-01

Highlights: • Catalyst heating points were analyzed using optical measurement techniques. • E20 shows stronger soot radiation and higher soot concentration as isooctane. • Different mixing formation of isooctane and E20 was determined. • Strong mixture stratification was identified for both fuels. • Remaining droplets and fuel rich regions are the main source for soot formation. - Abstract: In various research studies, ethanol blended fuels have shown reduced particulate matter (PM) emissions in comparison to gasoline and its surrogate fuels in direct-injection spark-ignition (DISI) engines. However, there are also studies reporting increased particulate concentration for fuels with low ethanol content. In this work the mixture formation and sooting combustion behavior of isooctane and the mixture E20 (20 vol% of ethanol in isooctane) is analyzed for catalyst heating operation. These operating conditions are critical as they strongly contribute to overall soot emissions in driving cycles. Simultaneous high speed imaging of OH ∗ –chemiluminescence and natural soot luminosity measurements are performed in combination with primary particle concentration measurements using a laser induced incandescence (LII) sensor in the engine exhaust duct. At these operating conditions E20 exhibits a higher sooting tendency as compared to isooctane. In order to identify the reason for increased soot formation, the mixture formation process is analyzed by planar laser induced fluorescence (LIF) measurements. The results show that soot was formed in fuel rich regions with incomplete evaporated fuel droplets remaining from the injection event. A different evaporation process of E20 fuel spray and mixing behavior is indicated showing a more compact rich mixture cloud with surrounding lean areas near the spark plug region. This mixture stratification is characterized by higher cyclic variations and constitutes a significant source of soot formation

Mixing state of regionally transported soot particles and the coating effect on their size and shape at a mountain site in Japan

Science.gov (United States)

Adachi, Kouji; Zaizen, Yuji; Kajino, Mizuo; Igarashi, Yasuhito

2014-05-01

Soot particles influence the global climate through interactions with sunlight. A coating on soot particles increases their light absorption by increasing their absorption cross section and cloud condensation nuclei activity when mixed with other hygroscopic aerosol components. Therefore, it is important to understand how soot internally mixes with other materials to accurately simulate its effects in climate models. In this study, we used a transmission electron microscope (TEM) with an auto particle analysis system, which enables more particles to be analyzed than a conventional TEM. Using the TEM, soot particle size and shape (shape factor) were determined with and without coating from samples collected at a remote mountain site in Japan. The results indicate that ~10% of aerosol particles between 60 and 350 nm in aerodynamic diameters contain or consist of soot particles and ~75% of soot particles were internally mixed with nonvolatile ammonium sulfate or other materials. In contrast to an assumption that coatings change soot shape, both internally and externally mixed soot particles had similar shape and size distributions. Larger aerosol particles had higher soot mixing ratios, i.e., more than 40% of aerosol particles with diameters >1 µm had soot inclusions, whereas <20% of aerosol particles with diameters <1 µm included soot. Our results suggest that climate models may use the same size distributions and shapes for both internally and externally mixed soot; however, changing the soot mixing ratios in the different aerosol size bins is necessary.

The Toxicological Mechanisms of Environmental Soot (Black Carbon and Carbon Black: Focus on Oxidative Stress and Inflammatory Pathways

Directory of Open Access Journals (Sweden)

Rituraj Niranjan

2017-06-01

Full Text Available The environmental soot and carbon blacks (CBs cause many diseases in humans, but their underlying mechanisms of toxicity are still poorly understood. Both are formed after the incomplete combustion of hydrocarbons but differ in their constituents and percent carbon contents. For the first time, “Sir Percival Pott” described soot as a carcinogen, which was subsequently confirmed by many others. The existing data suggest three main types of diseases due to soot and CB exposures: cancer, respiratory diseases, and cardiovascular dysfunctions. Experimental models revealed the involvement of oxidative stress, DNA methylation, formation of DNA adducts, and Aryl hydrocarbon receptor activation as the key mechanisms of soot- and CB-induced cancers. Metals including Si, Fe, Mn, Ti, and Co in soot also contribute in the reactive oxygen species (ROS-mediated DNA damage. Mechanistically, ROS-induced DNA damage is further enhanced by eosinophils and neutrophils via halide (Cl− and Br− dependent DNA adducts formation. The activation of pulmonary dendritic cells, T helper type 2 cells, and mast cells is crucial mediators in the pathology of soot- or CB-induced respiratory disease. Polyunsaturated fatty acids (PUFAs were also found to modulate T cells functions in respiratory diseases. Particularly, telomerase reverse transcriptase was found to play the critical role in soot- and CB-induced cardiovascular dysfunctions. In this review, we propose integrated mechanisms of soot- and CB-induced toxicity emphasizing the role of inflammatory mediators and oxidative stress. We also suggest use of antioxidants and PUFAs as protective strategies against soot- and CB-induced disorders.

Numerical Modelling of Soot Formation in Laminar Axisymmetric Ethylene-Air Coflow Flames at Atmospheric and Elevated Pressures

KAUST Repository

Rakha, Ihsan Allah

2015-05-01

The steady coflow diffusion flame is a widely used configuration for studying combustion kinetics, flame dynamics, and pollutant formation. In the current work, a set of diluted ethylene-air coflow flames are simulated to study the formation, growth, and oxidation of soot, with a focus on the effects of pressure on soot yield. Firstly, we assess the ability of a high performance CFD solver, coupled with detailed transport and kinetic models, to reproduce experimental measurements, like the temperature field, the species’ concentrations and the soot volume fraction. Fully coupled conservation equations for mass, momentum, energy, and species mass fractions are solved using a low Mach number formulation. Detailed finite rate chemistry describing the formation of Polycyclic Aromatic Hydrocarbons up to cyclopenta[cd]pyrene is used. Soot is modeled using a moment method and the resulting moment transport equations are solved with a Lagrangian numerical scheme. Numerical and experimental results are compared for various pressures. Reasonable agreement is observed for the flame height, temperature, and the concentrations of various species. In each case, the peak soot volume fraction is predicted along the centerline as observed in the experiments. The predicted integrated soot mass at pressures ranging from 4-8 atm, scales as P2.1, in satisfactory agreement with the measured integrated soot pressure scaling (P2.27). Significant differences in the mole fractions of benzene and PAHs, and the predicted soot volume fractions are found, using two well-validated chemical kinetic mechanisms. At 4 atm, one mechanism over-predicts the peak soot volume fraction by a factor of 5, while the other under-predicts it by a factor of 5. A detailed analysis shows that the fuel tube wall temperature has an effect on flame stabilization.

Investigation of mass and energy coupling between soot particles and gas species in modelling ethylene counterflow diffusion flames

NARCIS (Netherlands)

Zimmer, L.; Pereira, F.M.; van Oijen, J.A.; de Goey, L.P.H.

2017-01-01

A numerical model is developed aiming at investigating soot formation in ethylene counterflow diffusion flames. The mass and energy coupling between soot solid particles and gas-phase species is investigated in detail. A semi-empirical two-equation model is chosen for predicting soot mass fraction

Instabilities and soot formation in spherically expanding, high pressure, rich, iso-octane-air flames

International Nuclear Information System (INIS)

Lockett, R D

2006-01-01

Flame instabilities, cellular structures and soot formed in high pressure, rich, spherically expanding iso-octane-air flames have been studied experimentally using high speed Schlieren cinematography, OH fluorescence, Mie scattering and laser induced incandescence. Cellular structures with two wavelength ranges developed on the flame surface. The larger wavelength cellular structure was produced by the Landau-Darrieus hydrodynamic instability, while the short wavelength cellular structure was produced by the thermal-diffusive instability. Large negative curvature in the short wavelength cusps caused local flame quenching and fracture of the flame surface. In rich flames with equivalence ratio φ > 1.8, soot was formed in a honeycomb-like structure behind flame cracks associated with the large wavelength cellular structure induced by the hydrodynamic instability. The formation of soot precursors through low temperature pyrolysis was suggested as a suitable mechanism for the initiation of soot formation behind the large wavelength flame cracks

Instabilities and soot formation in spherically expanding, high pressure, rich, iso-octane-air flames

Energy Technology Data Exchange (ETDEWEB)

Lockett, R D [School of Engineering and Mathematical Sciences, City University, Northampton Square, London EC1V OHB (United Kingdom)

2006-07-15

Flame instabilities, cellular structures and soot formed in high pressure, rich, spherically expanding iso-octane-air flames have been studied experimentally using high speed Schlieren cinematography, OH fluorescence, Mie scattering and laser induced incandescence. Cellular structures with two wavelength ranges developed on the flame surface. The larger wavelength cellular structure was produced by the Landau-Darrieus hydrodynamic instability, while the short wavelength cellular structure was produced by the thermal-diffusive instability. Large negative curvature in the short wavelength cusps caused local flame quenching and fracture of the flame surface. In rich flames with equivalence ratio {phi} > 1.8, soot was formed in a honeycomb-like structure behind flame cracks associated with the large wavelength cellular structure induced by the hydrodynamic instability. The formation of soot precursors through low temperature pyrolysis was suggested as a suitable mechanism for the initiation of soot formation behind the large wavelength flame cracks.

Characterizing germania concentration and structure in fiber soot using multiphoton microscopy and spectroscopy technology

Science.gov (United States)

Chen, Minghan; Li, Ming-Jun; Liu, Anping

2015-02-01

Germania doping is commonly used in the core of optical fiber due to its advantages compared to other materials such as superior transparency in near-infrared telecommunication wavelength region. During fiber preform manufacturing using the outside vapor deposition (OVD) process, Ge is doped into a silica soot preform by chemical vapor deposition. Since the Ge doping concentration profile is directly correlated with the fiber refractive index profile, its characterization is critical for the fiber industry. Electron probe micro-analyzer (EPMA) is a conventional analysis method for characterizing the Ge concentration profile. However, it requires extensive sample preparation and lengthy measurement. In this paper, a multiphoton microscopy technique is utilized to measure the Ge doping profile based on the multiphoton fluorescence intensity of the soot layers. Two samples, one with ramped and another with stepped Ge doping profiles were prepared for measurements. Measured results show that the technique is capable of distinguishing ramped and stepped Ge doping profiles with good accuracy. In the ramped soot sample, a sharp increment of doping level was observed in about 2 mm range from soot edge followed by a relative slow gradient doping accretion. As for the stepped doping sample, step sizes ranging from around 1 mm (at soot edge) to 3 mm (at soot center) were observed. All the measured profiles are in close agreement with that of the EPMA measurements. In addition, both multiphoton fluorescence (around 420 nm) and sharp second harmonic generations (at 532 nm) were observed, which indicates the co-existence of crystal and amorphous GeO2.

Effects of Fuel Quantity on Soot Formation Process for Biomass-Based Renewable Diesel Fuel Combustion

KAUST Repository

Jing, Wei; Wu, Zengyang; Roberts, William L.; Fang, Tiegang

2016-01-01

Soot formation process was investigated for biomass-based renewable diesel fuel, such as biomass to liquid (BTL), and conventional diesel combustion under varied fuel quantities injected into a constant volume combustion chamber. Soot measurement

Automated determination of size and morphology information from soot transmission electron microscope (TEM)-generated images

International Nuclear Information System (INIS)

Wang, Cheng; Chan, Qing N.; Zhang, Renlin; Kook, Sanghoon; Hawkes, Evatt R.; Yeoh, Guan H.; Medwell, Paul R.

2016-01-01

The thermophoretic sampling of particulates from hot media, coupled with transmission electron microscope (TEM) imaging, is a combined approach that is widely used to derive morphological information. The identification and the measurement of the particulates, however, can be complex when the TEM images are of low contrast, noisy, and have non-uniform background signal level. The image processing method can also be challenging and time consuming, when the samples collected have large variability in shape and size, or have some degree of overlapping. In this work, a three-stage image processing sequence is presented to facilitate time-efficient automated identification and measurement of particulates from the TEM grids. The proposed processing sequence is first applied to soot samples that were thermophoretically sampled from a laminar non-premixed ethylene-air flame. The parameter values that are required to be set to facilitate the automated process are identified, and sensitivity of the results to these parameters is assessed. The same analysis process is also applied to soot samples that were acquired from an externally irradiated laminar non-premixed ethylene-air flame, which have different geometrical characteristics, to assess the morphological dependence of the proposed image processing sequence. Using the optimized parameter values, statistical assessments of the automated results reveal that the largest discrepancies that are associated with the estimated values of primary particle diameter, fractal dimension, and prefactor values of the aggregates for the tested cases, are approximately 3, 1, and 10 %, respectively, when compared with the manual measurements.

Automated determination of size and morphology information from soot transmission electron microscope (TEM)-generated images

Energy Technology Data Exchange (ETDEWEB)

Wang, Cheng; Chan, Qing N., E-mail: qing.chan@unsw.edu.au; Zhang, Renlin; Kook, Sanghoon; Hawkes, Evatt R.; Yeoh, Guan H. [UNSW, School of Mechanical and Manufacturing Engineering (Australia); Medwell, Paul R. [The University of Adelaide, Centre for Energy Technology (Australia)

2016-05-15

The thermophoretic sampling of particulates from hot media, coupled with transmission electron microscope (TEM) imaging, is a combined approach that is widely used to derive morphological information. The identification and the measurement of the particulates, however, can be complex when the TEM images are of low contrast, noisy, and have non-uniform background signal level. The image processing method can also be challenging and time consuming, when the samples collected have large variability in shape and size, or have some degree of overlapping. In this work, a three-stage image processing sequence is presented to facilitate time-efficient automated identification and measurement of particulates from the TEM grids. The proposed processing sequence is first applied to soot samples that were thermophoretically sampled from a laminar non-premixed ethylene-air flame. The parameter values that are required to be set to facilitate the automated process are identified, and sensitivity of the results to these parameters is assessed. The same analysis process is also applied to soot samples that were acquired from an externally irradiated laminar non-premixed ethylene-air flame, which have different geometrical characteristics, to assess the morphological dependence of the proposed image processing sequence. Using the optimized parameter values, statistical assessments of the automated results reveal that the largest discrepancies that are associated with the estimated values of primary particle diameter, fractal dimension, and prefactor values of the aggregates for the tested cases, are approximately 3, 1, and 10 %, respectively, when compared with the manual measurements.

Mobility and settling rate of agglomerates of polydisperse nanoparticles.

Science.gov (United States)

Spyrogianni, Anastasia; Karadima, Katerina S; Goudeli, Eirini; Mavrantzas, Vlasis G; Pratsinis, Sotiris E

2018-02-14

Agglomerate settling impacts nanotoxicology and nanomedicine as well as the stability of engineered nanofluids. Here, the mobility of nanostructured fractal-like SiO 2 agglomerates in water is investigated and their settling rate in infinitely dilute suspensions is calculated by a Brownian dynamics algorithm tracking the agglomerate translational and rotational motion. The corresponding friction matrices are obtained using the HYDRO++ algorithm [J. G. de la Torre, G. del Rio Echenique, and A. Ortega, J. Phys. Chem. B 111, 955 (2007)] from the Kirkwood-Riseman theory accounting for hydrodynamic interactions of primary particles (PPs) through the Rotne-Prager-Yamakawa tensor, properly modified for polydisperse PPs. Agglomerates are generated by an event-driven method and have constant mass fractal dimension but varying PP size distribution, mass, and relative shape anisotropy. The calculated diffusion coefficient from HYDRO++ is used to obtain the agglomerate mobility diameter d m and is compared with that from scaling laws for fractal-like agglomerates. The ratio d m /d g of the mobility diameter to the gyration diameter of the agglomerate decreases with increasing relative shape anisotropy. For constant d m and mean d p , the agglomerate settling rate, u s , increases with increasing PP geometric standard deviation σ p,g (polydispersity). A linear relationship between u s and agglomerate mass to d m ratio, m/d m , is revealed and attributed to the fast Brownian rotation of such small and light nanoparticle agglomerates. An analytical expression for the u s of agglomerates consisting of polydisperse PPs is then derived, u s =1-ρ f ρ p g3πμmd m (ρ f is the density of the fluid, ρ p is the density of PPs, μ is the viscosity of the fluid, and g is the acceleration of gravity), valid for agglomerates for which the characteristic rotational time is considerably shorter than their settling time. Our calculations demonstrate that the commonly made assumption of

Catalytic Oxidation of Soot on a Novel Active Ca-Co Dually-Doped Lanthanum Tin Pyrochlore Oxide

Directory of Open Access Journals (Sweden)

Lijie Ai

2018-04-01

Full Text Available A novel active Ca-Co dually-doping pyrochlore oxide La2−xCaxSn2−yCoyO7 catalyst was synthesized by the sol-gel method for catalytic oxidation of soot particulates. The microstructure, atomic valence, reduction, and adsorption performance were investigated by X-ray powder diffraction (XRD, scanning electron microscope (SEM, Fourier-transform infrared spectroscopy (FT-IR, X-ray photoelectron spectroscopy (XPS, H2-TPR (temperature-programmed reduction, and in situ diffuse reflection infrared Fourier transformed (DRIFTS techniques. Temperature programmed oxidation (TPO tests were performed with the mixture of soot-catalyst under tight contact conditions to evaluate the catalytic activity for soot combustion. Synergetic effect between Ca and Co improved the structure and redox properties of the solids, increased the surface oxygen vacancies, and provided a suitable electropositivity for oxide, directly resulting in the decreased ignition temperature for catalyzed soot oxidation as low as 317 °C. The presence of NO in O2 further promoted soot oxidation over the catalysts with the ignition temperature decreased to about 300 °C. The DRIFTS results reveal that decomposition of less stable surface nitrites may account for NO2 formation in the ignition period of soot combustion, which thus participate in the auxiliary combustion process.

Soot volume fraction fields in unsteady axis-symmetric flames by continuous laser extinction technique.

Science.gov (United States)

Kashif, Muhammad; Bonnety, Jérôme; Guibert, Philippe; Morin, Céline; Legros, Guillaume

2012-12-17

A Laser Extinction Method has been set up to provide two-dimensional soot volume fraction field time history at a tunable frequency up to 70 Hz inside an axis-symmetric diffusion flame experiencing slow unsteady phenomena preserving the symmetry. The use of a continuous wave laser as the light source enables this repetition rate, which is an incremental advance in the laser extinction technique. The technique is shown to allow a fine description of the soot volume fraction field in a flickering flame exhibiting a 12.6 Hz flickering phenomenon. Within this range of repetition rate, the technique and its subsequent post-processing require neither any method for time-domain reconstruction nor any correction for energy intrusion. Possibly complemented by such a reconstruction method, the technique should support further soot volume fraction database in oscillating flames that exhibit characteristic times relevant to the current efforts in the validation of soot processes modeling.

Optics of Water Microdroplets with Soot Inclusions: Exact Versus Approximate Results

Science.gov (United States)

Liu, Li; Mishchenko, Michael I.

2016-01-01

We use the recently generalized version of the multi-sphere superposition T-matrix method (STMM) to compute the scattering and absorption properties of microscopic water droplets contaminated by black carbon. The soot material is assumed to be randomly distributed throughout the droplet interior in the form of numerous small spherical inclusions. Our numerically-exact STMM results are compared with approximate ones obtained using the Maxwell-Garnett effective-medium approximation (MGA) and the Monte Carlo ray-tracing approximation (MCRTA). We show that the popular MGA can be used to calculate the droplet optical cross sections, single-scattering albedo, and asymmetry parameter provided that the soot inclusions are quasi-uniformly distributed throughout the droplet interior, but can fail in computations of the elements of the scattering matrix depending on the volume fraction of soot inclusions. The integral radiative characteristics computed with the MCRTA can deviate more significantly from their exact STMM counterparts, while accurate MCRTA computations of the phase function require droplet size parameters substantially exceeding 60.

Effect of Pore Structure on Soot Deposition in Diesel Particulate Filter

Directory of Open Access Journals (Sweden)

Kazuhiro Yamamoto

2016-12-01

Full Text Available Nowadays, in the after-treatment of diesel exhaust gas, a diesel particulate filter (DPF has been used to trap nano-particles of the diesel soot. However, as there are more particles inside the filter, the pressure which corresponds to the filter backpressure increases, which worsens the fuel consumption rate, together with the abatement of the available torque. Thus, a filter with lower backpressure would be needed. To achieve this, it is necessary to utilize the information on the phenomena including both the soot transport and its removal inside the DPF, and optimize the filter substrate structure. In this paper, to obtain useful information for optimization of the filter structure, we tested seven filters with different porosities and pore sizes. The porosity and pore size were changed systematically. To consider the soot filtration, the particle-laden flow was simulated by a lattice Boltzmann method (LBM. Then, the flow field and the pressure change were discussed during the filtration process.

Effect of dust and soot on the growth of spruce trees

Energy Technology Data Exchange (ETDEWEB)

Rohmeder, E

1960-07-01

The effect of chronic exposure to road dust, calcium carbonate and soot on plant growth, was investigated in an experiment with 40 spruces of common heredity that were three years old at the start of the experiment and five years old at its conclusion. The plants were exposed for the entire 1956 growing season to the effect of a heavy coating of dust. In the following year, the growth performance and the production of shoots and needle mass in plants treated with dust were substantially below the untreated control plants. The root mass produced was also smaller in the treated plants than in those untreated. The considerable growth retardation after a heavy layering of dust lasting one growing season is primarily explained by the withdrawal of light and the resultant reduction in assimilation performance. In exposure to soot, however, the corrosive effect of the chemicals contained in the soot increased the extent of the damage to the plants.

CFD modelling of polydispersed bubbly two-phase flow around an obstacle

International Nuclear Information System (INIS)

Krepper, Eckhard; Beyer, Matthias; Frank, Thomas; Lucas, Dirk; Prasser, Horst-Michael

2009-01-01

A population balance model (the Inhomogeneous MUSIG model) has recently been developed in close cooperation between ANSYS-CFX and Forschungszentrum Dresden-Rossendorf and implemented into the CFD-Code CFX [Krepper, E., Lucas, D., Prasser, H.-M, 2005. On the modelling of bubbly flow in vertical pipes. Nucl. Eng. Des. 235, 597-611; Frank, T., Zwart, P.J., Shi, J.-M., Krepper, E., Rohde, U., 2005. Inhomogeneous MUSIG Model-a population balance approach for polydispersed bubbly flows, International Conference 'Nuclear Energy for New Europe 2005', Bled, Slovenia, September 5-8, 2005; Krepper, E., Beyer, M., Frank, Th., Lucas, D., Prasser, H.-M., 2007. Application of a population balance approach for polydispersed bubbly flows, 6th Int. Conf. on Multiphase Flow Leipzig 2007, (paper 378)]. The current paper presents a brief description of the model principles. The capabilities of this model are discussed via the example of a bubbly flow around a half-moon shaped obstacle arranged in a 200 mm pipe. In applying the Inhomogeneous MUSIG approach, a deeper understanding of the flow structures is possible and the model allows effects of polydispersion to be investigated. For the complex flow around the obstacle, the general structure of the flow was well reproduced in the simulations. This test case demonstrates the complicated interplay between size dependent bubble migration and the effects of bubble coalescence and breakup on real flows. The closure models that characterize the bubble forces responsible for the simulation of bubble migration show agreement with the experimental observations. However, clear deviations occur for bubble coalescence and fragmentation. The models applied here, which describe bubble fragmentation and coalescence could be proved as a weakness in the validity of numerous CFD analyses of vertical upward two-phase pipe flow. Further work on this topic is under way.

Compositional effects on PAH and soot formation in counterflow diffusion flames of gasoline surrogate fuels

KAUST Repository

Park, Sungwoo

2017-02-05

Gasoline surrogate fuels are widely used to understand the fundamental combustion properties of complex refinery gasoline fuels. In this study, the compositional effects on polycyclic aromatic hydrocarbons (PAHs) and soot formation were investigated experimentally for gasoline surrogate mixtures comprising n-heptane, iso-octane, and toluene in counterflow diffusion flames. A comprehensive kinetic model for the gasoline surrogate mixtures was developed to accurately predict the fuel oxidation along with the formation of PAHs and soot in flames. This combined model was first tested against ignition delay times and laminar burning velocities data. The proposed model for the formation and growth of PAHs up to coronene (C24H12) was based on previous studies and was tested against existing and present new experimental data. Additionally, in the accompanied soot model, PAHs with sizes larger than (including) pyrene were used for the inception of soot particles, followed by particle coagulations and PAH condensation/chemical reactions on soot surfaces. The major pathways for the formation of PAHs were also identified for the surrogate mixtures. The model accurately captures the synergistic PAH formation characteristics observed experimentally for n-heptane/toluene and iso-octane/toluene binary mixtures. Furthermore, the present experimental and modeling results also elucidated different trends in the formation of larger PAHs and soot between binary n-heptane/iso-octane and ternary n-heptane/iso-octane/toluene mixtures. Propargyl radicals (C3H3) were shown to be important in the formation and growth of PAHs for n-heptane/iso-octane mixtures when the iso-octane concentration increased; however, reactions involving benzyl radicals (C6H5CH2) played a significant role in the formation of PAHs for n-heptane/iso-octane/toluene mixtures. These results indicated that the formation of PAHs and subsequently soot was strongly affected by the composition of gasoline surrogate mixtures.

Compositional effects on PAH and soot formation in counterflow diffusion flames of gasoline surrogate fuels

KAUST Repository

Park, Sungwoo; Wang, Yu; Chung, Suk-Ho; Sarathy, Mani

2017-01-01

Gasoline surrogate fuels are widely used to understand the fundamental combustion properties of complex refinery gasoline fuels. In this study, the compositional effects on polycyclic aromatic hydrocarbons (PAHs) and soot formation were investigated experimentally for gasoline surrogate mixtures comprising n-heptane, iso-octane, and toluene in counterflow diffusion flames. A comprehensive kinetic model for the gasoline surrogate mixtures was developed to accurately predict the fuel oxidation along with the formation of PAHs and soot in flames. This combined model was first tested against ignition delay times and laminar burning velocities data. The proposed model for the formation and growth of PAHs up to coronene (C24H12) was based on previous studies and was tested against existing and present new experimental data. Additionally, in the accompanied soot model, PAHs with sizes larger than (including) pyrene were used for the inception of soot particles, followed by particle coagulations and PAH condensation/chemical reactions on soot surfaces. The major pathways for the formation of PAHs were also identified for the surrogate mixtures. The model accurately captures the synergistic PAH formation characteristics observed experimentally for n-heptane/toluene and iso-octane/toluene binary mixtures. Furthermore, the present experimental and modeling results also elucidated different trends in the formation of larger PAHs and soot between binary n-heptane/iso-octane and ternary n-heptane/iso-octane/toluene mixtures. Propargyl radicals (C3H3) were shown to be important in the formation and growth of PAHs for n-heptane/iso-octane mixtures when the iso-octane concentration increased; however, reactions involving benzyl radicals (C6H5CH2) played a significant role in the formation of PAHs for n-heptane/iso-octane/toluene mixtures. These results indicated that the formation of PAHs and subsequently soot was strongly affected by the composition of gasoline surrogate mixtures.

Comparison of the tribology performance of nano-diesel soot and graphite particles as lubricant additives

International Nuclear Information System (INIS)

Zhang, Zu-chuan; Cai, Zhen-bing; Peng, Jin-fang; Zhu, Min-hao

2016-01-01

The tribology behavior of exhaust diesel soot as a lubricant additive was investigated and then compared with that of a selection of commercial nano-graphite particles. Specifically, 0.01 wt% particles were dispersed in PAO4 oil with 1 wt% sorbitan monooleate (Span 80) as a dispersing agent, and wear tests based on the ball against plate mode were conducted at various temperatures. Different analytical techniques (e.g. transmission electron, scanning electron and infrared microscopy; energy dispersive x-ray and Raman spectroscopy; and charge measurement) were employed to characterize the chemistry and morphology of the additives and their tribology performance. The oil containing only 0.01 wt% diesel soot clearly improved wear resistance over 60 °C. In particular, at 100 °C the wear rate decreased by approximately 90% compared to the function of base oil. In the same test conditions, diesel soot exhibited better anti-wear performance than nano-graphite at high temperatures. The potential measure showed that the nano-graphite had positive charge and the diesel soot had negative charge. Electrochemical action may play an important role in the lubricant mechanisms of diesel soot and graphite as oil additives. (paper)

Delayed condensation and frost formation on superhydrophobic carbon soot coatings by controlling the presence of hydrophilic active sites

Science.gov (United States)

Esmeryan, Karekin D.; Castano, Carlos E.; Mohammadi, Reza; Lazarov, Yuliyan; Radeva, Ekaterina I.

2018-02-01

Condensation frosting is an undesired natural phenomenon that could be impeded efficiently using appropriate wettability and morphologically patterned surfaces. The icephobic properties of carbon soot and the fabrication scalability of its synthesis method are a good foundation for anti-frosting applications; however, the fundamentals of frost growth and spreading on sooted surfaces have not been examined yet. In this study, we investigate the anti-frosting performance of three groups of superhydrophobic soot coatings by means of 16 MHz quartz crystal microbalances (QCMs). The analysis of the real-time sensor signal of each soot coated QCM pattern shows that frost formation and its propagation velocity depend on the quantity of oxygen functionalities and structural defects in the material. In turn, the reduction of both parameters shifts the onset of frost growth to temperatures below  -20 °C, whereas the interdroplet ice bridging is slowed by a factor of four. Moreover, high-resolution scanning electron micrographs of the samples imply delamination upon defrosting of the soot with spherical-like morphology via polar interactions driven mechanism. These results reveal an opportunity for control of frost incipiency on sooted surfaces by adjusting the synthesis conditions and depositing soot coatings with as low as possible content of hydrophilic active sites.

Soot measurements for diesel and biodiesel spray combustion under high temperature highly diluted ambient conditions

KAUST Repository

Zhang, Ji; Jing, Wei; Roberts, William L.; Fang, Tiegang

2014-01-01

This paper presents the soot temperature and KL factor for biodiesel, namely fatty acid methyl ester (FAME) and diesel fuel combustion in a constant volume chamber using a two-color technique. The KL factor is a parameter for soot concentration

Modeling the burnout of solid polydisperse fuel under the conditions of external heat transfer

Science.gov (United States)

Skorik, I. A.; Goldobin, Yu. M.; Tolmachev, E. M.; Gal'perin, L. G.

2013-11-01

A self-similar burnout mode of solid polydisperse fuel is considered taking into consideration heat transfer between fuel particles, gases, and combustion chamber walls. A polydisperse composition of fuel is taken into account by introducing particle distribution functions by radiuses obtained for the kinetic and diffusion combustion modes. Equations for calculating the temperatures of particles and gases are presented, which are written for particles average with respect to their distribution functions by radiuses taking into account the fuel burnout ratio. The proposed equations take into consideration the influence of fuel composition, air excess factor, and gas recirculation ratio. Calculated graphs depicting the variation of particle and gas temperatures, and the fuel burnout ratio are presented for an anthracite-fired boiler.

Quantitative effects of rapid heating on soot-particle sizing through analysis of two-pulse LII

KAUST Repository

Cenker, Emre; Roberts, William L.

2017-01-01

particle size, respectively. Overall, effects of these two processes on soot and LII model-based particle sizing are investigated by measuring the two-color time-resolved (2C-TiRe) LII signal decay from in-flame soot after two consecutive laser pulses

The circular thermo-phoretic spectrometer (CTSM), a new device for the study of the thermophoresis, Application on the fractals soot particles

International Nuclear Information System (INIS)

Brugiere, E.

2012-01-01

This work aims to improve the understanding of soot particle deposition by thermophoresis. In order to show the influence of the morphology of a fractal aggregate on its thermo-phoretic behavior, a new experimental device has been developed; the SpectroMetre Thermophoretique Circulaire (SMTC). This instrument is used to measure the mean thermo-phoretic velocity of particles selected between a hot plate and a cold plate thanks to a transfer function based on the geometry of the radial flow differential mobility analyser RF-DMA or SMEC (Spectrometre de Mobilite Electrique Circulaire). For the experimental validation, effective thermo-phoretic velocities of monodispersed spherical latex particles for diameters ranging from 64 nm to 500 nm and a temperature gradient equal to 50 750 K/m are measured and compared with theoretical values. The good agreement between the experimental results and theoretical values of Beresnev and Chernyak (1995) helps us to validate the operation of the instrument. Then we compare experimental thermo-phoretic velocity obtained with the SMTC for spherical particles and aggregates produced by a combustion aerosol generator. Contrary to the results obtained with the PSL particles, we observe that the thermo-phoretic velocity of aggregates increases with the electrical mobility diameter. Thanks to a morphological study of the aggregates, we showed that the thermo-phoretic velocity depends on the number of primary particles of the aggregate. These experimental results confirm, for the first time, the theoretical data of Mackowski (2006) obtained by a Monte Carlo simulation. Moreover, a comparison with the experimental results of Messerer et al. (2003) shows that the thermo-phoretic velocity of aggregates seems independent of the primary particle size. (author)

Effects of ambient oxygen concentration on soot temperature and concentration for biodiesel and diesel spray combustion

KAUST Repository

Zhang, Ji

2015-06-01

Ambient oxygen concentration, a key variable directly related to exhaust gas recirculation (EGR) levels in diesel engines, plays a significant role in particulate matter (PM) and nitrogen oxides (NOx) emissions. The utilization of biodiesel in diesel engines has been investigated over the last decades for its renewable characteristics and lower emissions compared to diesel. In an earlier work, we demonstrated that the soot temperature and concentration of biodiesel were lower than diesel under regular diesel engine conditions without EGR. Soot concentration was quantified by a parameter called KL factor. As a continuous effort, this paper presents an experimental investigation of the ambient oxygen concentration on soot temperature and KL factor during biodiesel and diesel spray combustion. The experiment was implemented in a constant volume chamber system, where the ambient oxygen concentration varied from 21 to 10% and the ambient temperature was kept to 1,000 K. A high speed two-color pyrometry technique was used to measure transient soot temperature and the KL factor of the spray flame. The soot temperature of biodiesel is found to be lower than that of diesel under the same conditions, which follows the same trend from our previous results found when the ambient temperature changes to 21% oxygen conditions. A reduction in ambient oxygen concentration generally reduces the soot temperature for both fuels. However, this is a complicated effect on soot processes as the change of oxygen concentration greatly affects the balance between soot formation and oxidation. The KL factor is observed to be the highest at 12% O2 for diesel and 18% O2 for biodiesel, respectively. On the other hand, the 10% O2 condition shows the lowest KL factor for both fuels. These results can provide quantitative experimental evidences to optimize the ambient oxygen concentration for diesel engines using different fuels for better emissions characteristics. © 2014 American Society of

Dynamic behavior of polydisperse dust system in cryogenic gas discharge complex plasmas

NARCIS (Netherlands)

Antipov, S.N.; Schepers, L.P.T.; Vasiliev, M.M.; Petrov, O.F.

2016-01-01

Complex (dusty) plasmas of micron-sized CeO2 polydisperse particles in dc glow discharges at 77 and ∼ 10 K were experimentally investigated. It was obtained that dust structure in cryogenic gas discharge plasma can be a mixture of two fractions (components) with completely different dust ordering

The immersion freezing behavior of size-segregated soot and kaolinite particles

Science.gov (United States)

Hartmann, S.; Augustin, S.; Clauss, T.; Niedermeier, D.; Raddatz, M.; Wex, H.; Shaw, R. A.; Stratmann, F.

2011-12-01

Heterogeneous ice nucleation plays a crucial role for ice formation in mixed-phase and cirrus clouds and has an important impact on precipitation formation, global radiation balances, and therefore Earth's climate (Cantrell and Heymsfield, 2005). Mineral dust and soot particles are found to be a major component of ice crystal residues (e.g., Pratt et al., 2009) so these substances are potential sources of atmospheric ice nuclei (IN). Experimental studies investigating the immersion freezing behavior of size-segregated soot and kaolinite particles conducted at the Leipzig Aerosol Cloud Interaction Simulator (LACIS) are presented. In our measurements only one aerosol particle is immersed in an air suspended water droplet which can trigger ice nucleation. The method facilitates very precise examinations with respect to temperature, ice nucleation time and ice nucleus size. Considering laboratory studies, the picture of the IN ability of soot particles is quite heterogeneous. Our studies show that submicron flame, spark soot particles and optionally coated with sulfuric acid to simulate chemically aging do not act as IN at temperatures higher than homogeneous freezing taking place. Therefore soot particles might not be an important source of IN for immersion freezing in the atmosphere. In contrast, kaolinite being representative for natural mineral dust with a well known composition and structure is found to be very active in forming ice for all freezing modes (e.g., Mason and Maybank, 1958). Analyzing the immersion freezing behavior of different sized kaolinite particles (300, 500 and 700 nm in diameter) the size effect was clearly observed, i.e. the ice fraction (number of frozen droplets per total number) scales with particle surface, i.e. the larger the ice nucleus surface the higher the ice fraction. The slope of the logarithm of the ice fraction as function of temperature is similar for all particle sizes investigated and fits very well with the results of L�

Soot, organics, and ultrafine ash from air- and oxy-fired coal combustion

KAUST Repository

Andersen, Myrrha E.

2016-10-19

Pulverized bituminous coal was burned in a 10. W externally heated entrained flow furnace under air-combustion and three oxy-combustion inlet oxygen conditions (28, 32, and 36%). Experiments were designed to produce flames with practically relevant stoichiometric ratios (SR. =1.2-1.4) and constant residence times (2.3. s). Size-classified fly ash samples were collected, and measurements focused on the soot, elemental carbon (EC), and organic carbon (OC) composition of the total and ultrafine (<0.6. μm) fly ash. Results indicate that although the total fly ash carbon, as measured by loss on ignition, was always acceptably low (<2%) with all three oxy-combustion conditions lower than air-combustion, the ultrafine fly ash for both air-fired and oxy-fired combustion conditions consists primarily of carbonaceous material (50-95%). Carbonaceous components on particles <0.6. μm measured by a thermal optical method showed that large fractions (52-93%) consisted of OC rather than EC, as expected. This observation was supported by thermogravimetric analysis indicating that for the air, 28% oxy, and 32% oxy conditions, 14-71% of this material may be OC volatilizing between 100. C and 550. C with the remaining 29-86% being EC/soot. However, for the 36% oxy condition, OC may comprise over 90% of the ultrafine carbon with a much smaller EC/soot contribution. These data were interpreted by considering the effects of oxy-combustion on flame attachment, ignition delay, and soot oxidation of a bituminous coal, and the effects of these processes on OC and EC emissions. Flame aerodynamics and inlet oxidant composition may influence emissions of organic hazardous air pollutants (HAPs) from a bituminous coal. During oxy-coal combustion, judicious control of inlet oxygen concentration and placement may be used to minimize organic HAP and soot emissions.

Simulation of an electrostatic soot-filter with continuous electrochemical conversion during the stages of development

International Nuclear Information System (INIS)

Muri, M.

1996-04-01

The dissertation describes the simulation of an electrostatic Diesel-Soot-Converter during its stages of development. This simulation is not only necessary for the interpretation of the experimental results, it also shows results for assumptions that cannot be received experimentally. The Diesel-Soot-Converter consists of a charging electrode, which charges the particles by a high-voltage and a ceramic monolith, where the particles are precipitated in the open channels because of an electric field created also by a high-voltage. Afterwards the particles are burned by a plasma. The filter-function of the Diesel-Soot-Converter was formulated and the efficiency for a vehicle was calculated. In the first part of the calculation the mass flow of a BMW 318tds and a BMW 325tds was determined for an US-FTP75-testcycle and for fuel load. In the second part the efficiency of different Diesel-Soot-Converter-types was calculated for the US-FTP75-testcycle and for full load. The use of the program with other testcycles is possible. The results of the calculations show the best configuration of the Diesel-Soot-Converter for the corresponding vehicle. Therefore with the help of this program time and money for the production of the ceramic can be saved. (author)

Soot volume fraction in a piloted turbulent jet non-premixed flame of natural gas

Energy Technology Data Exchange (ETDEWEB)

Qamar, N.H.; Alwahabi, Z.T.; King, K.D. [Fluid Mechanics, Energy and Combustion Group, University of Adelaide, Adelaide, SA 5005 (Australia); School of Chemical Engineering, University of Adelaide, Adelaide, SA 5005 (Australia); Chan, Q.N. [Fluid Mechanics, Energy and Combustion Group, University of Adelaide, Adelaide, SA 5005 (Australia); School of Chemical Engineering, University of Adelaide, Adelaide, SA 5005 (Australia); School of Mechanical Engineering, University of Adelaide, Adelaide, SA 5005 (Australia); Nathan, G.J. [Fluid Mechanics, Energy and Combustion Group, University of Adelaide, Adelaide, SA 5005 (Australia); School of Mechanical Engineering, University of Adelaide, Adelaide, SA 5005 (Australia); Roekaerts, D. [Department of Multi-Scale Physics, Faculty of Applied Sciences, Delft University of Technology, Lorentzweg, 1, NL-2628 CJ Delft (Netherlands)

2009-07-15

Planar laser-induced incandescence (LII) has been used to measure soot volume fraction in a well-characterised, piloted, turbulent non-premixed flame known as the ''Delft Flame III''. Simulated Dutch natural gas was used as the fuel to produce a flame closely matching those in which a wide range of previous investigations, both experimental and modelling, have been performed. The LII method was calibrated using a Santoro-style burner with ethylene as the fuel. Instantaneous and time-averaged data of the axial and radial soot volume fraction distributions of the flame are presented here along with the Probability Density Functions (PDFs) and intermittency. The PDFs were found to be well-characterised by a single exponential distribution function. The distribution of soot was found to be highly intermittent, with intermittency typically exceeding 97%, which increases measurement uncertainty. The instantaneous values of volume fraction are everywhere less than the values in strained laminar flames. This is consistent with the soot being found locally in strained flame sheets that are convected and distorted by the flow. (author)

TEM study of soot, organic aerosol, and sea-salt particles collected during CalNex

Science.gov (United States)

Adachi, K.; Buseck, P. R.

2010-12-01

Anthropogenic aerosol particles are emitted in abundance from megacities. Those particles can have important effects on both human health and climate. In this study, aerosol particles having aerodynamic diameters between 50 and 300 nm were collected during the CalNex campaign at the Pasadena ground site from May 15 to June 15, 2010, ~15 km northeast of downtown Los Angeles. The samples were analyzed using transmission electron microscopes (TEMs) to characterize particle shapes and compositions. Most samples are dominated by soot, organic aerosol (OA), sulfate, sea salt, or combinations thereof. Sizes and amounts of OA particles increased during the afternoons, and most soot particles were internally mixed with OA and sulfate in the afternoons. The proportion of soot to other material in individual particles increased and soot particles were more compact during the nights and early mornings. Sea-salt particles were commonly internally mixed with other materials. They have high Na contents with lesser N, Mg, S, K, and Ca and almost no Cl, suggesting that the Cl was replaced by sulfate or nitrate in the atmosphere. There is less OA and more sea salt and sulfate in the CalNex samples than in the samples from Mexico City that were collected during the MILAGRO campaign. Our study indicates that compositions of internally mixed aerosol particles and shapes of soot particles change significantly within a day. These changes probably influence the estimates of their effects on human health and climate.

Carbon Nanostructure of Diesel Soot Particles Emitted from 2 and 4 Stroke Marine Engines Burning Different Fuels.

Science.gov (United States)

Lee, Won-Ju; Park, Seul-Hyun; Jang, Se-Hyun; Kim, Hwajin; Choi, Sung Kuk; Cho, Kwon-Hae; Cho, Ik-Soon; Lee, Sang-Min; Choi, Jae-Hyuk

2018-03-01

Diesel soot particles were sampled from 2-stroke and 4-stroke engines that burned two different fuels (Bunker A and C, respectively), and the effects of the engine and fuel types on the structural characteristics of the soot particle were analyzed. The carbon nanostructures of the sampled particles were characterized using various techniques. The results showed that the soot sample collected from the 4-stroke engine, which burned Bunker C, has a higher degree of order of the carbon nanostructure than the sample collected from the 2-stroke engine, which burned Bunker A. Furthermore, the difference in the exhaust gas temperatures originating from the different engine and fuel types can affect the nanostructure of the soot emitted from marine diesel engines.

Sensitivity analysis of Immersed Boundary Method simulations of fluid flow in dense polydisperse random grain packings

Directory of Open Access Journals (Sweden)

Knight Chris

2017-01-01

Full Text Available Polydisperse granular materials are ubiquitous in nature and industry. Despite this, knowledge of the momentum coupling between the fluid and solid phases in dense saturated grain packings comes almost exclusively from empirical correlations [2–4, 8] with monosized media. The Immersed Boundary Method (IBM is a Computational Fluid Dynamics (CFD modelling technique capable of resolving pore scale fluid flow and fluid-particle interaction forces in polydisperse media at the grain scale. Validation of the IBM in the low Reynolds number, high concentration limit was performed by comparing simulations of flow through ordered arrays of spheres with the boundary integral results of Zick and Homsy [10]. Random grain packings were studied with linearly graded particle size distributions with a range of coefficient of uniformity values (Cu = 1.01, 1.50, and 2.00 at a range of concentrations (ϕ ∈ [0.396; 0.681] in order to investigate the influence of polydispersity on drag and permeability. The sensitivity of the IBM results to the choice of radius retraction parameter [1] was investigated and a comparison was made between the predicted forces and the widely used Ergun correlation [3].

Investigating Soot Morphology in Counterflow Flames at Elevated Pressures

KAUST Repository

Amin, Hafiz Muhammad Fahid

2018-01-01

Practical combustion devices such as gas turbines and diesel engines operate at high pressures to increase their efficiency. Pressure significantly increases the overall soot yield. Morphology of these ultra-fine particles determines their airborne

Simple heuristic for the viscosity of polydisperse hard spheres

Science.gov (United States)

Farr, Robert S.

2014-12-01

We build on the work of Mooney [Colloids Sci. 6, 162 (1951)] to obtain an heuristic analytic approximation to the viscosity of a suspension any size distribution of hard spheres in a Newtonian solvent. The result agrees reasonably well with rheological data on monodispserse and bidisperse hard spheres, and also provides an approximation to the random close packing fraction of polydisperse spheres. The implied packing fraction is less accurate than that obtained by Farr and Groot [J. Chem. Phys. 131(24), 244104 (2009)], but has the advantage of being quick and simple to evaluate.

Role of engine age and lubricant chemistry on the characteristics of EGR soot

Science.gov (United States)

Adeniran, Olusanmi Adeniji

Exhaust products of Diesel Engines serves as an environmental hazard, and to curtail this problem a Tier 3 emission standard was introduced which involves change in engine designs and introduction of EGR systems in Diesel engines. EGR systems, however has the challenge of generating soot which are abrasive and are major causes of wear in Diesel engines. This work has studied the characteristics of EGR soot formed in different range of engine age and in different lubricant chemistries of Mineral and Synthetic based diesel Oils. It is found that lubricant degradation is encouraged by less efficient combustion as engine age increases, and these are precursors to formation of crystalline and amorphous particles that are causes of wear in Diesel Engines. It is found that soot from new engine is dominated by calcium based crystals which are from calcium sulfonate detergent, which reduces formation of second phase particles that can be abrasive. Diversity and peak intensity is seen to increase in soot samples as engine age increases. This understanding of second phase particles formed in engines across age ranges can help in the durability development of engine, improvement of Oil formulation for EGR engines, and in development of chemistries for after-treatment Oil solutions that can combat formation of abrasive particles in Oils.

Oil soot measurement system of diesel engine; Diesel engine no oil sutsu sokutei sochi

Energy Technology Data Exchange (ETDEWEB)

Mizuno, Y; Moritsugu, M; Kato, N [Nippon Soken, Inc., Tokyo (Japan); Osaki, R [Denso Corp., Aichi (Japan)

1997-10-01

For use evaluate diesel engine in laboratory, we have developed a apparatus which can measure soot density in engine oil instantly and accurately. We have achieved accuracy of 0.03 wt% by employing the following; (1) utilize a ligh-reflecting oil soot sensor, (2) regurate the temperature and flow of the in-coming oil to be constant. 4 refs., 12 figs., 2 tabs.

Th effectiveness of soot removal techniques for the recovery of fingerprints on glass fire debris in petrol bomb cases

International Nuclear Information System (INIS)

Umi Kalthom Ahmad; Mei, Y.S.; Mohd Shahru Bahari; Raramasivam, V.K.

2011-01-01

The increased use of petrol bombs as an act of vengeance in Malaysia has heightened awareness for the need of research relating physical evidence found at the crime scene to the perpetrator of the crime. A study was therefore carried out to assess the effectiveness of soot removal techniques on glass fire debris without affecting the fingerprints found on the evidence. Soot was removed using three methods which were brushing, 2 % NaOH solution and tape lifting. Depending on the visibility of prints recovered, prints which were visible after soot removal were lifted directly while prints that were not visible were subjected to enhancement. Glass microscope slides were used in laboratory experiment and subjected to control burn for the formation of soot. Soot was later removed following enhancement of the prints over time (within 1 day, within 2 days and after 2 days). While in simulated petrol bomb ground experiment, petrol bombs were hurled in glass bottles and the fragments were collected. Favorable results were obtained in varying degrees using each soot removal methods. In laboratory testing, brushing and 2 % NaOH solution revealed fingerprints that were visible after removal of excess soot and were lifted directly. As for tape lifting technique, some prints were visible and were successfully lifted while those that were not visible were subjected to super glue fuming for effective fingerprint identification. (author)

Soot and short-lived pollutants provide political opportunity

Science.gov (United States)

Victor, David G.; Zaelke, Durwood; Ramanathan, Veerabhadran

2015-09-01

Cutting levels of soot and other short-lived pollutants delivers tangible benefits and helps governments to build confidence that collective action on climate change is feasible. After the Paris climate meeting this December, actually reducing these pollutants will be essential to the credibility of the diplomatic process.

Modelling and Simulation of Packed Bed Catalytic Converter for Oxidation of Soot in Diesel Powered Vehicles Flue Gas

Directory of Open Access Journals (Sweden)

Mohammad Nasikin

2010-10-01

Full Text Available Diesel vehicle is used in Indonesia in very big number. This vehicle exhausts pollutants especially diesel soot that can be reduces by using a catalytic converter to convert the soot to CO2. To obtain the optimal dimension of catalytic converter it is needed a model that can represent the profile of soot weight, temperature and pressure along the catalytic converter. In this study, a model is developed for packed bed catalytic converter in an adiabatic condition based on a kinetic study that has been  reported previously. Calculation of developed equations in this model uses Polymath 5.X solver with Range Kutta Method. The simulation result shows that temperature profile along catalytic converter increases with the decrease of soot weight,  while pressure profile decreases. The increase of soot weight in entering gas increases the needed converter length. On the other hand, the increase of catalyst diameter does not affect to soot weight along converter and temperature profile, but results a less pressure drop. For 2.500 c diesel engine, packed bed catalytic converter with ellipse's cross sectional of 14,5X7,5 cm diagonal and 0,8 cm catalyst particle diameter, needs 4,1 cm length.

Study on soot particle formation and oxidation in DI diesel engine; Chokufunshiki diesel kikan ni okeru susu ryushi no seicho sanka ni kansuru kenkyu

Energy Technology Data Exchange (ETDEWEB)

Kurata, K; Senda, J; Fujimoto, H [Doshisha University, Kyoto (Japan); Asai, G [Yanmar Diesel Engine Co. Ltd., Osaka (Japan)

1997-10-01

To clarify soot formation and oxidation process in diesel combustion, the natural emission of OH radical and the flame temperature were obtained in the combustion chamber of D.I. diesel engine. Further, soot were detected by LII (Laser Induced Incandescence) and LIS (Laser Induced Scattering) technique to assess the relative soot diameter and its number density. OH emission and flame temperature were compared with data of soot diameter and number- density. The results show that : (1) OH emission has relation to flame temperature. (2) OH emission arises latter than soot emission, because early soot at early combustion consume OH to oxidate. (3) As soon as it is ignited, soot particles are formed in the region of low temperature. 6 refs., 7 figs., 2 tabs.

The effect of soot on ammonium nitrate species and NO2 selective catalytic reduction over Cu-zeolite catalyst-coated particulate filter.

Science.gov (United States)

Mihai, Oana; Tamm, Stefanie; Stenfeldt, Marie; Olsson, Louise

2016-02-28

A selective catalytic reduction (SCR)-coated particulate filter was evaluated by means of dynamic tests performed using NH3, NO2, O2 and H2O. The reactions were examined both prior to and after soot removal in order to study the effect of soot on ammonium nitrate formation and decomposition, ammonia storage and NO2 SCR. A slightly larger ammonia storage capacity was observed when soot was present in the sample, which indicated that small amounts of ammonia can adsorb on the soot. Feeding of NO2 and NH3 in the presence of O2 and H2O at low temperature (150, 175 and 200°C) leads to a large formation of ammonium nitrate species and during the subsequent temperature ramp using H2O and argon, a production of nitrous oxides was observed. The N2O formation is often related to ammonium nitrate decomposition, and our results showed that the N2O formation was clearly decreased by the presence of soot. We therefore propose that in the presence of soot, there are fewer ammonium nitrate species on the surface due to the interactions with the soot. Indeed, we do observe CO2 production during the reaction conditions also at 150°C, which shows that there is a reaction with these species and soot. In addition, the conversion of NOx due to NO2 SCR was significantly enhanced in the presence of soot; we attribute this to the smaller amount of ammonium nitrate species present in the experiments where soot is available since it is well known that ammonium nitrate formation is a major problem at low temperature due to the blocking of the catalytic sites. Further, a scanning electron microscopy analysis of the soot particles shows that they are about 30-40 nm and are therefore too large to enter the pores of the zeolites. There are likely CuxOy or other copper species available on the outside of the zeolite crystallites, which could have been enhanced due to the hydrothermal treatment at 850°C of the SCR-coated filter prior to the soot loading. We therefore propose that soot is

Morphological transformation of soot: investigation of microphysical processes during the condensation of sulphuric acid and limonene ozonolysis products vapours

Science.gov (United States)

Pathak, R. K. P.; Pei, X.; Hallquist, M.; Pagels, J. H.

2017-12-01

Morphological transformation of soot particle by condensation of low volatility materials on it is a dominant atmospheric process with serious implications for its optical and hygroscopic properties, and atmospheric lifetime. In this study, the morphological transformation of soot agglomerate under the influence of condensation of vapours of sulphuric acid, and/or limonene ozonolysis products were investigated systematically using a Differential Mobility Analyser-Aerosol Particle Mass Analyser (DMA-APM) and the Tandem DMA techniques integrated with a laminar flow-tube system. We discovered that the morphology transformation of soot in general was a sequence of two-step process, i.e. (i) filling of void space within soot agglomerate; (ii) growth of particle diameter. These two steps followed and complimented each other. In the very beginning the filling was the dominant process followed by growth until it led to the accumulation of enough material that in turn exerted surface forces that eventually facilitated the further filling. The filling of void space was constrained by the initial morphology of fresh soot and the nature and amount of the material condensed. This process continued in several sequential steps until all void space within the soot agglomerate was filled completely and then growth of a spherical particle continued as long as mass was condensed on it. In this study, we developed a framework to quantify the microphysical transformation of soot upon the condensation of various materials. The framework utilized experimental data and hypothesis of ideal sphere growth and filling of voids to quantify the distribution of condensed materials in these two processes complimenting each other. Using this framework, we have quantified the percentage of material that went into processes of particle growth and void filling at each step. Using the same framework, we further estimated the fraction of internal voids and open voids and used this information to derive

Impact on vehicle fuel economy of the soot loading on diesel particulate filters made of different substrate materials

International Nuclear Information System (INIS)

Millo, Federico; Andreata, Maurizio; Rafigh, Mahsa; Mercuri, Davide; Pozzi, Chiara

2015-01-01

Wall flow DPFs (Diesel Particulate Filters) are nowadays universally adopted for all European passenger cars. Since the properties of the filter substrate material play a fundamental role in determining the optimal soot loading level to be reached before DPF regeneration, three different filter material substrates (Silicon Carbide, Aluminum Titanate and Cordierite) were investigated in this work, considering different driving conditions, after treatment layouts and regeneration strategies. In the first step of the research, an experimental investigation on the three different substrates over the NEDC (New European Driving Cycle) was performed. The data obtained from experiments were then used for the calibration and the validation of a one dimensional fluid-dynamic engine and after treatment simulation model. Afterward, the model was used to predict the vehicle fuel consumption increments as a function of the exhaust back pressure due to the soot loading for different driving cycles. The results showed that appreciable fuel consumption increments could be noticed only in particular driving conditions, and, as a consequence, in most of the cases the optimal filter regeneration strategy corresponds to reach the highest soot loading that still ensures the component safety even in case of uncontrolled regeneration events. - Highlights: • Three different substrate materials for a Diesel Particulate Filter were investigated. • Fuel consumption increases due to DPF soot loading were generally not appreciable. • Optimal soot loading before regeneration was the highest safeguarding DPF integrity. • SiC substrate showed highest soot load limit and lowest fuel consumption penalties. • AT and Cd substrate properties lead to lower soot load limits than SiC

Experiments in polydisperse two-phase turbulent flows

International Nuclear Information System (INIS)

Bachalo, W.D.; Houser, M.J.

1985-01-01

Aspects of turbulent two-phase flow measurements obtained with a laser Doppler velocimeter that was modified to also obtain particle size were investigated. Simultaneous measurements of the particle size and velocity allowed the determination of the lag characteristics of particles over a range of sizes. Relatively large particles were found to respond well to the turbulent fluctuations in low speed flows. Measurements of sprays were obtained at various points throughout the spray plume. Velocity measurements for each drop size class were obtained and revealed the relative velocity relaxation with downstream distance. The evolution of the rms velocities for each size class was also examined. Difficulties associated with seeding polydispersions to obtain gas phase turbulence data were discussed. Several approaches for mitigating the errors due to seed particle concentration bias were reviewed

Evaluation and optimisation of phenomenological multi-step soot model for spray combustion under diesel engine-like operating conditions

DEFF Research Database (Denmark)

Pang, Kar Mun; Jangi, Mehdi; Bai, Xue-Song

2015-01-01

with the spray combustion solver. Prior to the soot modelling, combustion simulations are carried out. Numerical results show that the ignition delay times and lift-off lengths exhibit good agreement with the experimental measurements across a wide range of operating conditions, apart from those in the cases......, variation of spatial soot distribution and soot mass produced at oxygen molar fractions ranging from 10.0 to 21.0% for both low and high density conditions are reproduced....

Effect of acid on the aggregation of poly(ethylene xide)-poly(propylene oxide)-poly(ethylene oxide) block copolymers.

Science.gov (United States)

Yang, Bin; Guo, Chen; Chen, Shu; Ma, Junhe; Wang, Jing; Liang, Xiangfeng; Zheng, Lily; Liu, Huizhou

2006-11-23

The acid effect on the aggregation of poly(ethylene oxide)-poly(propylene oxide)-poly(ethylene oxide) block copolymers EO(20)PO(70)EO(20) has been investigated by transmission electron microscopy (TEM), particle size analyzer (PSA), Fourier transformed infrared, and fluorescence spectroscopy. The critical micellization temperature for Pluronic P123 in different HCl aqueous solutions increases with the increase of acid concentration. Additionally, the hydrolysis degradation of PEO blocks is observed in strong acid concentrations at higher temperatures. When the acid concentration is low, TEM and PSA show the increase of the micelle mean diameter and the decrease of the micelle polydispersity at room temperature, which demonstrate the extension of EO corona and tendency of uniform micelle size because of the charge repulsion. When under strong acid conditions, the aggregation of micelles through the protonated water bridges was observed.

Influence of fuel properties on fundamental spray characteristics and soot emissions using different tailor-made fuels from biomass

International Nuclear Information System (INIS)

García, Antonio; Monsalve-Serrano, Javier; Heuser, Benedikt; Jakob, Markus; Kremer, Florian; Pischinger, Stefan

2016-01-01

Highlights: • TMFB show clear potential to reduce soot emissions under mixing-controlled combustion. • The larger lift-off-length of 2-MTHF and 1-octanol promotes soot emissions reduction. • Oxidation process governs the improved soot emissions of DNBE. - Abstract: This work evaluates the potential of some new biomass-derived fuels as candidates for compression ignition operation. Thus, fundamental spray characteristics related to fuel vaporization and fuel/air mixing process for 2-Methyltetrahydrofuran, Di-n-butyl ether and 1-octanol has been studied and compared with conventional EN590 Diesel fuel. For this purpose, OH"∗ chemiluminescence and shadowgraphy measurements in a high pressure chamber as well as 1D simulations with a spray model have been carried out at different operating conditions representative of the NEDC driving cycle. Finally, measured soot emissions in the single-cylinder engine were presented and discussed. Results from the high pressure chamber presented very good agreement in terms of liquid length and vapor penetration with simulation results. Thus, some analytical expressions related to macroscopic spray characteristics have been proposed and validated experimentally for all four fuels. Finally, the single-cylinder engine results confirmed the relevant role of soot formation on final emissions for 1-octanol and 2-MTHF. In addition, DNBE showed greater soot oxidation potential than diesel and other TMFB candidates.

Differential dynamic microscopy of weakly scattering and polydisperse protein-rich clusters

Science.gov (United States)

Safari, Mohammad S.; Vorontsova, Maria A.; Poling-Skutvik, Ryan; Vekilov, Peter G.; Conrad, Jacinta C.

2015-10-01

Nanoparticle dynamics impact a wide range of biological transport processes and applications in nanomedicine and natural resource engineering. Differential dynamic microscopy (DDM) was recently developed to quantify the dynamics of submicron particles in solutions from fluctuations of intensity in optical micrographs. Differential dynamic microscopy is well established for monodisperse particle populations, but has not been applied to solutions containing weakly scattering polydisperse biological nanoparticles. Here we use bright-field DDM (BDDM) to measure the dynamics of protein-rich liquid clusters, whose size ranges from tens to hundreds of nanometers and whose total volume fraction is less than 10-5. With solutions of two proteins, hemoglobin A and lysozyme, we evaluate the cluster diffusion coefficients from the dependence of the diffusive relaxation time on the scattering wave vector. We establish that for weakly scattering populations, an optimal thickness of the sample chamber exists at which the BDDM signal is maximized at the smallest sample volume. The average cluster diffusion coefficient measured using BDDM is consistently lower than that obtained from dynamic light scattering at a scattering angle of 90∘. This apparent discrepancy is due to Mie scattering from the polydisperse cluster population, in which larger clusters preferentially scatter more light in the forward direction.

Polydispersity of liposome preparations as a likely source of peak width in capillary zone electrophoresis

Czech Academy of Sciences Publication Activity Database

Radko, S. P.; Šťastná, Miroslava; Chrambach, A.

2001-01-01

Roč. 761, č. 1 (2001), s. 69-75 ISSN 0378-4347 Institutional research plan: CEZ:AV0Z4031919 Keywords : polydispersity * liposomes Subject RIV: CB - Analytical Chemistry, Separation Impact factor: 1.911, year: 2001

Effects of Lignocellulosic Compounds on the Yield, Nanostructure and Reactivity of Soot from Fast Pyrolysis at High Temperatures

DEFF Research Database (Denmark)

Trubetskaya, Anna; Broström, Markus; Kling, Jens

reactor. The specific objectives of this study were to: (1) obtain knowledge about lignocellulosic compounds and monolignols influence on the yield, nanostructure, composition, and reactivity of soot during high-temperature gasification, (2) understand the influence of Soxhlet extraction on the soot......Gasification offers the utilization of biomass to a wide variety of applications such as heat, electricity, chemicals and transport fuels in an efficient and sustainable manner. High soot yields in the high-temperature entrained flow gasification lead to intensive gas cleaning and can cause...... primary, secondary and teriary pyrolysis products such as organic acids, aldehydes and phenolics [1]. In this study, therefore, the impacts of lignocellulosic compounds and monolignols (syringol, guaiacol, p-hydroxyphenol) on the yield and characteristics of soot were investigated at 1250°C in a drop tube...

Visualizing the mobility of silver during catalytic soot oxidation

DEFF Research Database (Denmark)

Gardini, Diego; Christensen, Jakob M.; Damsgaard, Christian Danvad

2016-01-01

The catalytic activity and mobility of silver nanoparticles used as catalysts in temperature programmed oxidation of soot:silver (1:5 wt:wt) mixtures have been investigated by means of flow reactor experiments and in situ environmental transmission electron microscopy (ETEM). The carbon oxidation...

Soot accumulation in diesel particulate filters using ULSD and B20 biodiesel fuel blends

Energy Technology Data Exchange (ETDEWEB)

Charbonneau, P.; Wallace, J.S. [Toronto Univ., ON (Canada)

2009-07-01

Soot accumulation in a diesel particulate filter was investigated using a newly developed dissection method that loads and dissects diesel particulate filters (DPFs). In particular, this study examined the differences in soot accumulation between ultra-low sulphur diesel (ULSD) and a B20 biodiesel blend. DPFs loaded for exposure times of 1, 2, 5 and 10 hours. Scanning electron microscopy (SEM) was used to analyze the samples of the filter substrate. The differences in particulate size and number distribution between fuels were attributed to performance differences in DPFs. ULSD loaded filters experienced increased loading and a greater pressure drop across the filters. According to SEM images, the soot cake was a relatively shallow feature increasing in density to form discrete coarse agglomerates and cakes. It was concluded that this newly developed methodology has potential for future studies in DPF loading.

Soot in the atmosphere and snow surface of Antarctica

International Nuclear Information System (INIS)

Warren, S.G.; Clarke, A.D.

1990-01-01

Samples of snow collected near the south pole during January and February 1986 were analyzed for the presence of light-absorbing particles by passing the melted snow through a nuclepore filter. Transmission of light through the filter showed that snow far from the station contains the equivalent of 0.1-0.3 ng of carbon per gram of snow (ng/g). Samples of ambient air were filtered and found to contain about 1-2 ng of carbon per kilogram of air, giving a scavenging ratio of about 150. The snow downwind of the station exhibited a well-defined plume of soot due to the burning of diesel fuel, but even in the center of the plume 1 km downwind, the soot concentration was only 3 ng/g, too small to affect snow albedo significantly. Measurements of snow albedo near large inland stations are therefore probably representative of their surrounding regions

Smog chamber study on aging of combustion soot in isoprene/SO2/NOx system: Changes of mass, size, effective density, morphology and mixing state

Science.gov (United States)

Li, Kangwei; Chen, Linghong; Han, Ke; Lv, Biao; Bao, Kaiji; Wu, Xuecheng; Gao, Xiang; Cen, Kefa

2017-02-01

Atmospheric soot aging process is always accompanied by secondary particle formation, which is a comprehensive environmental issue that deserves great attention. On one hand, aging of primary soot could change its own physicochemical properties; on the other hand, complex air pollution caused by pollutant emission from various sources (e.g., vehicle exhausts, coal-fired flue gases and biogenic VOCs emission) may contribute to secondary particle formation onto primary particle surface. In this study, aging of combustion soot in isoprene/SO2/NOx system was investigated under controlled laboratory conditions in several smog chamber experiments. During the evolution of soot, several physical properties such as mass, size, effective density, morphology and mixing state were determined simultaneously by an integrated aerosol analytical system of Scanning Mobility Particle Sizer (SMPS), Differential Mobility Analyzer-Aerosol Particle Mass Analyzer-Condensation Particle Counter (DMA-APM-CPC) and Transmission Electron Microscopy coupled with Energy-dispersive X-ray Spectrometry (TEM/EDX) techniques. Here, based on the experimental results of soot aging under different gas-phase composition and relative humidity (RH), we firstly proposed possible aging pathways of soot in isoprene/SO2/NOx system. A synergetic effect was speculated to exist between SO2 and isoprene on soot aging process, which led to more secondary particle formation. At the same time, TEM/EDX analysis showed that a competitive mechanism between H2SO4(g) and isoprene oxidation vapor may exist: H2SO4(g) firstly condensed onto fresh soot, then an acceleration of isoprene oxidation products formed onto H2SO4 pre-coated soot. In isoprene/SO2/NOx system, high RH conditions could contribute to soot aging and new particle formation. The changes of effective density and dynamic shape factor of soot also indicated that high RH conditions could accelerate soot aging process, and led chain-like soot into more spherical

Characterization and Purification of Polydisperse Reconstituted Lipoproteins and Nanolipoprotein Particles

Directory of Open Access Journals (Sweden)

Paul D. Hoeprich

2009-07-01

Full Text Available Heterogeneity is a fact that plagues the characterization and application of many self-assembled biological constructs. The importance of obtaining particle homogeneity in biological assemblies is a critical goal, as bulk analysis tools often require identical species for reliable interpretation of the results—indeed, important tools of analysis such as x-ray diffraction typically require over 90% purity for effectiveness. This issue bears particular importance in the case of lipoproteins. Lipid-binding proteins known as apolipoproteins can self assemble with liposomes to form reconstituted high density lipoproteins (rHDLs or nanolipoprotein particles (NLPs when used for biotechnology applications such as the solubilization of membrane proteins. Typically, the apolipoprotein and phospholipids reactants are self assembled and even with careful assembly protocols the product often contains heterogeneous particles. In fact, size polydispersity in rHDLs and NLPs published in the literature are frequently observed, which may confound the accurate use of analytical methods. In this article, we demonstrate a procedure for producing a pure, monodisperse NLP subpopulation from a polydisperse self-assembly using size exclusion chromatography (SEC coupled with high resolution particle imaging by atomic force microscopy (AFM. In addition, NLPs have been shown to self assemble both in the presence and absence of detergents such as cholate, yet the effects of cholate on NLP polydispersity and separation has not been systematically examined. Therefore, we examined the separation properties of NLPs assembled in both the absence and presence of cholate using SEC and native gel electrophoresis. From this analysis, NLPs prepared with and without cholate showed particles with well defined diameters spanning a similar size range. However, cholate was shown to have a dramatic affect on NLP separation by SEC and native gel electrophoresis. Furthermore, under

Investigation of soot morphology and particle size distrib ution in a turbulent nonpremixed flame via Monte Carlo simulations

KAUST Repository

Abdelgadir, Ahmed

2015-03-30

Recently, our group performed a set of direct numerical simulations (DNS) of soot formation and growth in a n-heptane three dimensional non-premixed jet flame [Attili et al., Proc. Comb. Inst, 35, 2015], [Attili et al., Comb. Flame, 161, 2014], [Bisetti et al.,Trans of the Royal Soc, 372, 2014]. The evolution of species relevant to soot formation and growth have been sampled along a large number of Lagrangian trajectories in the DNS. In this work, the DNS results are post-processed to compute the soot evolution along selected Lagrangian trajectories using a Monte Carlo method. An operator splitting approach is adopted to split the deterministic processes (nucleation, surface growth and oxidation) from coagulation, which is treated stochastically. The morphological properties of soot and the particlesize distribution are investigated. For trajectories that experience an early strong nucleation event, the particle size distribution is found to be bimodal, as the soot particles have enough time to coagulate and grow while it is unimodal for trajectories characterized by only late nucleation events. As a results, the average size distribution at two different crosswise positions in the flame is unimodal.

Soot Aerosol Particles as Cloud Condensation Nuclei: from Ice Nucleation Activity to Ice Crystal Morphology

Science.gov (United States)

Pirim, Claire; Ikhenazene, Raouf; Ortega, Isamel Kenneth; Carpentier, Yvain; Focsa, Cristian; Chazallon, Bertrand; Ouf, François-Xavier

2016-04-01

Emissions of solid-state particles (soot) from engine exhausts due to incomplete fuel combustion is considered to influence ice and liquid water cloud droplet activation [1]. The activity of these aerosols would originate from their ability to be important centers of ice-particle nucleation, as they would promote ice formation above water homogeneous freezing point. Soot particles are reported to be generally worse ice nuclei than mineral dust because they activate nucleation at higher ice-supersaturations for deposition nucleation and at lower temperatures for immersion freezing than ratios usually expected for homogeneous nucleation [2]. In fact, there are still numerous opened questions as to whether and how soot's physico-chemical properties (structure, morphology and chemical composition) can influence their nucleation ability. Therefore, systematic investigations of soot aerosol nucleation activity via one specific nucleation mode, here deposition nucleation, combined with thorough structural and compositional analyzes are needed in order to establish any association between the particles' activity and their physico-chemical properties. In addition, since the morphology of the ice crystals can influence their radiative properties [3], we investigated their morphology as they grow over both soot and pristine substrates at different temperatures and humidity ratios. In the present work, Combustion Aerosol STandart soot samples were produced from propane using various experimental conditions. Their nucleation activity was studied in deposition mode (from water vapor), and monitored using a temperature-controlled reactor in which the sample's relative humidity is precisely measured with a cryo-hygrometer. Formation of water/ice onto the particles is followed both optically and spectroscopically, using a microscope coupled to a Raman spectrometer. Vibrational signatures of hydroxyls (O-H) emerge when the particle becomes hydrated and are used to characterize ice

High-quality poly-dispersed mixtures applied in additive 3D technologies.

Science.gov (United States)

Gerasimov, M. D.; Brazhnik, Yu V.; Gorshkov, P. S.; Latyshev, S. S.

2018-03-01

The paper describes the new mixer design to obtain high-quality poly-dispersed powders applied in additive 3D technologies. It also considers a new mixing principle of dry powder particles ensuring the distribution of such particles in the total volume, which is close to ideal. The paper presents the mathematical model of mixer operation providing for the quality assessment of the ready mixtures. Besides, it demonstrates experimental results and obtained rational values of mixer process parameters.

Experiments and Model Development for the Investigation of Sooting and Radiation Effects in Microgravity Droplet Combustion

Science.gov (United States)

Choi, Mun Young; Yozgatligil, Ahmet; Dryer, Frederick L.; Kazakov, Andrei; Dobashi, Ritsu

2001-01-01

Today, despite efforts to develop and utilize natural gas and renewable energy sources, nearly 97% of the energy used for transportation is derived from combustion of liquid fuels, principally derived from petroleum. While society continues to rely on liquid petroleum-based fuels as a major energy source in spite of their finite supply, it is of paramount importance to maximize the efficiency and minimize the environmental impact of the devices that burn these fuels. The development of improved energy conversion systems, having higher efficiencies and lower emissions, is central to meeting both local and regional air quality standards. This development requires improvements in computational design tools for applied energy conversion systems, which in turn requires more robust sub-model components for combustion chemistry, transport, energy transport (including radiation), and pollutant emissions (soot formation and burnout). The study of isolated droplet burning as a unidimensional, time dependent model diffusion flame system facilitates extensions of these mechanisms to include fuel molecular sizes and pollutants typical of conventional and alternative liquid fuels used in the transportation sector. Because of the simplified geometry, sub-model components from the most detailed to those reduced to sizes compatible for use in multi-dimensional, time dependent applied models can be developed, compared and validated against experimental diffusion flame processes, and tested against one another. Based on observations in microgravity experiments on droplet combustion, it appears that the formation and lingering presence of soot within the fuel-rich region of isolated droplets can modify the burning rate, flame structure and extinction, soot aerosol properties, and the effective thermophysical properties. These observations led to the belief that perhaps one of the most important outstanding contributions of microgravity droplet combustion is the observation that in the

Effect of diluents on soot precursor formation and temperature in ethylene laminar diffusion flames

KAUST Repository

Abhinavam Kailasanathan, Ranjith Kumar

2013-03-01

Soot precursor species concentrations and flame temperature were measured in a diluted laminar co-flow jet diffusion flame at pressures up to eight atmospheres while varying diluent type. The objective of this study was to gain a better understanding of soot production and oxidation mechanisms, which could potentially lead to a reduction in soot emissions from practical combustion devices. Gaseous samples were extracted from the centerline of an ethylene-air laminar diffusion flame, which was diluted individually with four diluents (argon, helium, nitrogen, and carbon dioxide) to manipulate flame temperature and transport properties. The diluted fuel and co-flow exit velocities (top-hat profiles) were matched at all pressures to minimize shear-layer effects, and the mass fluxes were fixed over the pressure range to maintain constant Reynolds number. The flame temperature was measured using a fine gauge R-type thermocouple at pressures up to four atmospheres. Centerline concentration profiles of major non-fuel hydrocarbons collected via extractive sampling with a quartz microprobe and quantification using GC/MS+FID are reported within. The measured hydrocarbon species concentrations are vary dramatically with pressure and diluent, with the helium and carbon dioxide diluted flames yielding the largest and smallest concentrations of soot precursors, respectively. In the case of C2H2 and C6H6, two key soot precursors, helium diluted flames had concentrations more than three times higher compared with the carbon dioxide diluted flame. The peak flame temperature vary with diluents tested, as expected, with carbon dioxide diluted flame being the coolest, with a peak temperature of 1760K at 1atm, and the helium diluted flame being the hottest, with a peak temperature of 2140K. At four atmospheres, the helium diluted flame increased to 2240K, but the CO2 flame temperature increased more, decreasing the difference to approximately 250K. © 2012 The Combustion Institute.

Sooting behavior of oxygenated fuels in a diffusion burner

NARCIS (Netherlands)

Boot, M.D.; Luijten, C.C.M.; Baert, R.S.G.; Edenhofer, R.; Dirks, H.; Lucka, K.; Köhne, H.

2009-01-01

Different strategies are being investigated towards reducing engine-out emission levels of soot and NOx of modern Diesel engines. A fuel-based strategy currently under investigation, entails the use of low cetane number (CN; i.e.low reactive) oxygenates. Previous research has shown that low CN

Improved soot blowing, based on needs, through measurement of the natural frequency of the heat transferring tubes; Foerbaettrad behovsstyrd sotning genom maetning av oeverfoerande tubernas egenfrekvens

Energy Technology Data Exchange (ETDEWEB)

Blom, Elisabet; Ivarsson, Christofer

2007-11-15

The aim of the project is to develop a method for detecting soot on the transferring tubes by measuring the Eigen frequency of the tubes as a function of the soot deposit growth. The project is a pilot study independent of boiler type and it is applicable to all boilers where soot deposit on transferring tubes is a repeating issue. The report is supposed to answer two major questions. Is it possible to make use of Eigen frequencies in order to trace soot deposit on transferring tubes? What governing parameters are related to the Eigen frequency of transferring tubes? By today, soot blowing is executed after recommendations from the manufacturer in terms of number of soot blowing per time unit. The fuel type as well as boiler type has great influence on the soot deposit growth. The objective of the project is to investigate whether the mechanical properties of the transferring tube can be used to detect soot deposit. The project is divided into a theoretical and a practical part. The theoretical part covers the design of the probe and the change of its mechanical properties when soot deposit is present. Practical experiments were then carried out in a laboratory were the probes mechanical properties with and without soot deposit were investigated. It was shown that the Eigen frequency of the probe decreased with an increased mass due to soot deposit. A test was also made in a boiler at SAKAB but difficulties in attaching the probe to the inspection hatch. The results varied and the interpretation of the results become difficult. However, it was obvious that the mechanical properties of the probe changed with the amount of soot deposit. It was concluded that detection of soot deposit by studying the mechanical properties of the transferring tubes is possible. Yet, using a probe is no optimal solution, instead measurements should be done directly on the heat transferring tubes. In addition, a strategy for controlling the soot deposit has to be developed

Candle soot nanoparticles-polydimethylsiloxane composites for laser ultrasound transducers

Science.gov (United States)

Chang, Wei-Yi; Huang, Wenbin; Kim, Jinwook; Li, Sibo; Jiang, Xiaoning

2015-10-01

Generation of high power laser ultrasound strongly demands the advanced materials with efficient laser energy absorption, fast thermal diffusion, and large thermoelastic expansion capabilities. In this study, candle soot nanoparticles-polydimethylsiloxane (CSNPs-PDMS) composite was investigated as the functional layer for an optoacoustic transducer with high-energy conversion efficiency. The mean diameter of the collected candle soot carbon nanoparticles is about 45 nm, and the light absorption ratio at 532 nm wavelength is up to 96.24%. The prototyped CSNPs-PDMS nano-composite laser ultrasound transducer was characterized and compared with transducers using Cr-PDMS, carbon black (CB)-PDMS, and carbon nano-fiber (CNFs)-PDMS composites, respectively. Energy conversion coefficient and -6 dB frequency bandwidth of the CSNPs-PDMS composite laser ultrasound transducer were measured to be 4.41 × 10-3 and 21 MHz, respectively. The unprecedented laser ultrasound transduction performance using CSNPs-PDMS nano-composites is promising for a broad range of ultrasound therapy applications.

Hybrid sparse blind deconvolution: an implementation of SOOT algorithm to real data

Science.gov (United States)

Pakmanesh, Parvaneh; Goudarzi, Alireza; Kourki, Meisam

2018-06-01

Getting information of seismic data depends on deconvolution as an important processing step; it provides the reflectivity series by signal compression. This compression can be obtained by removing the wavelet effects on the traces. The recently blind deconvolution has provided reliable performance for sparse signal recovery. In this study, two deconvolution methods have been implemented to the seismic data; the convolution of these methods provides a robust spiking deconvolution approach. This hybrid deconvolution is applied using the sparse deconvolution (MM algorithm) and the Smoothed-One-Over-Two algorithm (SOOT) in a chain. The MM algorithm is based on the minimization of the cost function defined by standards l1 and l2. After applying the two algorithms to the seismic data, the SOOT algorithm provided well-compressed data with a higher resolution than the MM algorithm. The SOOT algorithm requires initial values to be applied for real data, such as the wavelet coefficients and reflectivity series that can be achieved through the MM algorithm. The computational cost of the hybrid method is high, and it is necessary to be implemented on post-stack or pre-stack seismic data of complex structure regions.

Fundamental insight in soot oxidation over a Ag/Co₃O₄ catalyst by means of Environmental TEM

DEFF Research Database (Denmark)

Gardini, Diego; Christiansen, J. M.; Jensen, Anker Degn

A novel Ag/Co3O4 catalyst for low-temperature soot oxidation has been studied by means of environmental TEM in order to get fundamental insight in the oxidation mechanism. Soot particles generated in diesel engines are responsible for respiratory diseases, lung cancer and affect the climate both...... on preparation method, degree of contact with the soot and temperature range. In order to fully understand the role of the single constituents and the influence of different operating conditions in the overall catalytic activity, flow reactor experiments have been coupled with in situ soot oxidation...

Characterization of enzymatically induced aggregation of casein micelles in natural concentration by in situ static light scattering and ultra low shear viscosimetry

DEFF Research Database (Denmark)

Lehner, D.; Worning, Peder; G, Fritz

1999-01-01

of multiple scattering whenthe transmission is above 0.85. Due to the very complex and porous structure of the casein aggregates theRayleigh-Debye-Gans scattering theory has been used in the data analysis. Measurements with a newinstrument using ultra low shear showed good agreement with theory. Copyright......The aggregation of casein micelles in undiluted skim milk after the addition of chymosin was studied bystatic light scattering and ultra low shear viscometry. The static light scattering measurements were madewith two different sample thicknesses, 72 and 16 mum. The scattering data were analyzed...... by indirect Fouriertransformation and by the polydispersity inversion technique which led to pair distance distributionfunctions and size distribution function, respectively. The minimum scattering angle was 1 degrees, whichallows for the determination of particle sizes up to a maximum diameter of 12 mum...

Combustion and Gasification Collection of Diesel Soot by Means of Microwave Heating

Directory of Open Access Journals (Sweden)

Xueshi YAO

2014-06-01

Full Text Available The experiment of integrated purification of diesel soot was made by means of microwave heating. The experiment includes combustion and gasification collection. The catalytic effect of ceramic carrier was used in the combustion process. In order to improve the purification efficiency of PM2.5 particles, the surfactants were used in gasification collection. The model of computer control was set up so that the purification course could be controlled. The experimental principle was analyzed. Experiment result indicated that the diesel soot purifying efficiency is more than 90 %. The purification efficiency can be improved further by the optimization design of experimental device.

Investigation of soot by two-color four-wave mixing

Energy Technology Data Exchange (ETDEWEB)

Hemmerling, B; Stampanoni-Panariello, A [Paul Scherrer Inst. (PSI), Villigen (Switzerland)

1999-08-01

A novel, non-intrusive technique has been used for the temporally resolved investigation of the interaction of laser radiation and soot in a flame. While there is a fairly good agreement between measurement and simulation remaining discrepancies indicate some shortcomings of the model employed. (author) 2 figs., 2 refs.

Effects of non-unity Lewis number of gas-phase species in turbulent nonpremixed sooting flames

KAUST Repository

Attili, Antonio

2016-02-13

Turbulence statistics from two three-dimensional direct numerical simulations of planar n-heptane/air turbulent jets are compared to assess the effect of the gas-phase species diffusion model on flame dynamics and soot formation. The Reynolds number based on the initial jet width and velocity is around 15, 000, corresponding to a Taylor scale Reynolds number in the range 100 ≤ Reλ ≤ 150. In one simulation, multicomponent transport based on a mixture-averaged approach is employed, while in the other the gas-phase species Lewis numbers are set equal to unity. The statistics of temperature and major species obtained with the mixture-averaged formulation are very similar to those in the unity Lewis number case. In both cases, the statistics of temperature are captured with remarkable accuracy by a laminar flamelet model with unity Lewis numbers. On the contrary, a flamelet with a mixture-averaged diffusion model, which corresponds to the model used in the multi-component diffusion three-dimensional DNS, produces significant differences with respect to the DNS results. The total mass of soot precursors decreases by 20-30% with the unity Lewis number approximation, and their distribution is more homogeneous in space and time. Due to the non-linearity of the soot growth rate with respect to the precursors\\' concentration, the soot mass yield decreases by a factor of two. Being strongly affected by coagulation, soot number density is not altered significantly if the unity Lewis number model is used rather than the mixture-averaged diffusion. The dominant role of turbulent transport over differential diffusion effects is expected to become more pronounced for higher Reynolds numbers. © 2016 The Combustion Institute.

Effects of non-unity Lewis number of gas-phase species in turbulent nonpremixed sooting flames

KAUST Repository

Attili, Antonio; Bisetti, Fabrizio; Mueller, Michael E.; Pitsch, Heinz

2016-01-01

Turbulence statistics from two three-dimensional direct numerical simulations of planar n-heptane/air turbulent jets are compared to assess the effect of the gas-phase species diffusion model on flame dynamics and soot formation. The Reynolds number based on the initial jet width and velocity is around 15, 000, corresponding to a Taylor scale Reynolds number in the range 100 ≤ Reλ ≤ 150. In one simulation, multicomponent transport based on a mixture-averaged approach is employed, while in the other the gas-phase species Lewis numbers are set equal to unity. The statistics of temperature and major species obtained with the mixture-averaged formulation are very similar to those in the unity Lewis number case. In both cases, the statistics of temperature are captured with remarkable accuracy by a laminar flamelet model with unity Lewis numbers. On the contrary, a flamelet with a mixture-averaged diffusion model, which corresponds to the model used in the multi-component diffusion three-dimensional DNS, produces significant differences with respect to the DNS results. The total mass of soot precursors decreases by 20-30% with the unity Lewis number approximation, and their distribution is more homogeneous in space and time. Due to the non-linearity of the soot growth rate with respect to the precursors' concentration, the soot mass yield decreases by a factor of two. Being strongly affected by coagulation, soot number density is not altered significantly if the unity Lewis number model is used rather than the mixture-averaged diffusion. The dominant role of turbulent transport over differential diffusion effects is expected to become more pronounced for higher Reynolds numbers. © 2016 The Combustion Institute.

A review of the literature on soot production during in-situ burning of oil

International Nuclear Information System (INIS)

Fraser, J.; Buist, I.

1997-01-01

Available literature on soot production during in-situ burning of oil was reviewed to determine the range of smoke yields generated by in-situ burning of petroleum oils in water, and to determine the effects of the size of fire and the type of oil burned. For crude oil, data sets statistical analysis showed that, with a fairly high degree of confidence, smoke yield increases with fire diameter. Based on a limited number of available data sets for identifiable oil types, it appears that most oils (Arabian crude the only exception) show roughly the same correlation of smoke yield with fire diameter. Pool fires from aromatic hydrocarbons such as toluene appear to produce more soot than similar fires with crude oil. Fires of lower molecular weight non-aromatics produce an order of magnitude less soot than crude oil fires. Predictive equations with correlation coefficients are provided for specific crude oils. 50 refs., 5 tabs., 13 figs

Soot formation characteristics of gasoline surrogate fuels in counterflow diffusion flames

KAUST Repository

Choi, Byungchul; Choi, Sangkyu; Chung, Suk-Ho

2011-01-01

The characteristics of polycyclic aromatic hydrocarbon (PAH) and soot for gasoline surrogate fuels have been investigated in counterflow diffusion flames by adopting laser-induced fluorescence (LIF) and laser-induced incandescence (LII) techniques

Photoacoustic Soot Spectrometer (PASS) Instrument Handbook

Energy Technology Data Exchange (ETDEWEB)

Dubey, M [Los Alamos National Laboratory; Springston, S [Brookhaven National Laboratory; Koontz, A [Pacific Northwest National Laboratory; Aiken, A [Los Alamos National Laboratory

2013-01-17

The photoacoustic soot spectrometer (PASS) measures light absorption by aerosol particles. As the particles pass through a laser beam, the absorbed energy heats the particles and in turn the surrounding air, which sets off a pressure wave that can be detected by a microphone. The PASS instruments deployed by ARM can also simultaneously measure the scattered laser light at three wavelengths and therefore provide a direct measure of the single-scattering albedo. The Operator Manual for the PASS-3100 is included here with the permission of Droplet Measurement Technologies, the instrument’s manufacturer.

Soot temperature and KL factor for biodiesel and diesel spray combustion in a constant volume combustion chamber

KAUST Repository

Zhang, Ji

2013-07-01

This paper presents measurements of the soot temperature and KL factor for biodiesel and diesel combustion in a constant volume chamber using a two-color technique. This technique uses a high-speed camera coupled with two narrowband filters (550. nm and 650. nm, 10. nm FWHM). After calibration, statistical analysis shows that the uncertainty of the two-color temperature is less than 5%, while it is about 50% for the KL factor. This technique is then applied to the spray combustion of biodiesel and diesel fuels under an ambient oxygen concentration of 21% and ambient temperatures of 800, 1000 and 1200. K. The heat release result shows higher energy utilization efficiency for biodiesel compared to diesel under all conditions; meanwhile, diesel shows a higher pressure increase due to its higher heating value. Biodiesel yields a lower temperature inside the flame area, a longer soot lift-off length, and a smaller soot area compared to diesel. Both the KL factor and the total soot with biodiesel are lower than with diesel throughout the entire combustion process, and this difference becomes larger as the ambient temperature decreases. Biodiesel shows approximately 50-100. K lower temperatures than diesel at the quasi-steady stage for 1000 and 1200. K ambient temperature, while diesel shows a lower temperature than biodiesel at 800. K ambient. This result may raise the question of how important the flame temperature is in explaining the higher NO. x emissions often observed during biodiesel combustion. Other factors may also play an important role in controlling NO. x emissions. Both biodiesel and diesel temperature measurements show a monotonic dependence on the ambient temperature. However, the ambient temperature appears to have a more significant effect on the soot formation and oxidation in diesel combustion, while biodiesel combustion soot characteristics shows relative insensitivity to the ambient temperature. © 2013 Elsevier Ltd.

Measurement of Soot Volume Fraction and Temperature for Oxygen-Enriched Ethylene Combustion Based on Flame Image Processing

Directory of Open Access Journals (Sweden)

Weijie Yan

2017-05-01

Full Text Available A method for simultaneously visualizing the two-dimensional distributions of temperature and soot volume fraction in an ethylene flame was presented. A single-color charge-coupled device (CCD camera was used to capture the flame image in the visible spectrum considering the broad-response spectrum of the R and G bands of the camera. The directional emissive power of the R and G bands were calibrated and used for measurement. Slightly increased temperatures and reduced soot concentration were predicted in the central flame without self-absorption effects considered, an iterative algorithm was used for eliminating the effect of self-absorption. Nine different cases were presented in the experiment to demonstrate the effects of fuel mass flow rate and oxygen concentration on temperature and soot concentration in three different atmospheres. For ethylene combustion in pure-air atmosphere, as the fuel mass flow rate increased, the maximum temperature slightly decreased, and the maximum soot volume fraction slightly increased. For oxygen fractions of 30%, 40%, and 50% combustion in O2/N2 oxygen-enhanced atmospheres, the maximum flame temperatures were 2276, 2451, and 2678 K, whereas combustion in O2/CO2 atmospheres were 1916, 2322, and 2535 K. The maximum soot volume fractions were 4.5, 7.0, and 9.5 ppm in oxygen-enriched O2/N2 atmosphere and 13.6, 15.3, and 14.8 ppm in oxygen-enriched O2/CO2 atmosphere. Compared with the O2/CO2 atmosphere, combustion in the oxygen-enriched O2/N2 atmosphere produced higher flame temperature and larger soot volume fraction. Preliminary results indicated that this technique is reliable and can be used for combustion diagnosis.

Numerical investigation of soot formation and oxidation processes under large two-stroke marine diesel engine-like conditions using integrated CFD-chemical kinetics

DEFF Research Database (Denmark)

Pang, Kar Mun; Karvounis, Nikolas; Walther, Jens Honore

2016-01-01

n-heptane mechanism and a revised multi-step soot model using laser extinction measurements of diesel soot obtained at different ambient pressure levels in an optical accessible, constant volume chamber experiment. It is revealed that ignition delay times and liftoff lengths generated using the new......In this reported work, multi-dimensional computational fluid dynamics studies of diesel combustion and soot formation processes in a constant volume combustion chamber and a marine diesel engine are carried out. The key interest here is firstly to validate the coupling of a newly developed skeletal...... using the revised soot model agrees reasonably well with the measurements in terms of peak values. The numerical model is subsequently applied to investigate the flame development, soot/nitrogen monoxide formation and heat transfer in a two-stroke, low-speed uniflow-scavenged marine diesel engine...

Intelligent soot blowing for boilers co-firing waste and biofuel; Behovsstyrd sotblaasning foer bio- och avfallseldade pannor - inventering och teknikval

Energy Technology Data Exchange (ETDEWEB)

Kjoerk, Anders [S.E.P. Scandinavian Energy Project AB, Goeteborg (Sweden)

2003-11-01

To achieve optimum boiler operation and performance it is necessary to control the cleanliness and limit the fouling of the heat transfer surfaces. Historically, the heating surfaces in boilers firing biomass and waste are cleaned by steamblowing soot blowers on scheduled time-based and/or parameter-based intervals or by mechanical methods. With the advent of fuel switching strategies and use of mixed-in industrial waste, the control of heating surface cleanliness has become even more crucial for these boilers. Scheduled and/or parameter based approaches do not easily address operational changes. As plant operators push to achieve greater efficiency and performance from their boilers, the ability to more effectively optimize cleaning cycles has become increasingly important. If soot blowing is done only when and where it is required rather than at set intervals, unit performance can be maintained with reduced blowing, which saves steam. Two philosophical approaches toward intelligent soot blowing are currently being applied in the industry. One incorporates heat flux monitors to gather real-time heat transfer data to determine which areas of the furnace need cleaning. The other uses indirect temperature and pressure data to infer locations where soot blowing is needed, and is mainly applied for controlling soot blowers in the superheater and economiser area. The heat flux monitors are so fare used for control of the furnace wall blowers. A system using temperature, pressure and flow data does not require much additional instrumentation as compared with what is available on a standard boiler. However the blower control system must be capable of operating blowers on an individual basis. For advanced options it should also be possible to adjust the speed of the soot blower and the steam pressure. The control program could be more or less advanced but the ability to model heating surfaces and determine real-time cleanliness is crucial for an intelligent soot blowing

The pdf approach to turbulent polydispersed two-phase flows

Science.gov (United States)

Minier, Jean-Pierre; Peirano, Eric

2001-10-01

The purpose of this paper is to develop a probabilistic approach to turbulent polydispersed two-phase flows. The two-phase flows considered are composed of a continuous phase, which is a turbulent fluid, and a dispersed phase, which represents an ensemble of discrete particles (solid particles, droplets or bubbles). Gathering the difficulties of turbulent flows and of particle motion, the challenge is to work out a general modelling approach that meets three requirements: to treat accurately the physically relevant phenomena, to provide enough information to address issues of complex physics (combustion, polydispersed particle flows, …) and to remain tractable for general non-homogeneous flows. The present probabilistic approach models the statistical dynamics of the system and consists in simulating the joint probability density function (pdf) of a number of fluid and discrete particle properties. A new point is that both the fluid and the particles are included in the pdf description. The derivation of the joint pdf model for the fluid and for the discrete particles is worked out in several steps. The mathematical properties of stochastic processes are first recalled. The various hierarchies of pdf descriptions are detailed and the physical principles that are used in the construction of the models are explained. The Lagrangian one-particle probabilistic description is developed first for the fluid alone, then for the discrete particles and finally for the joint fluid and particle turbulent systems. In the case of the probabilistic description for the fluid alone or for the discrete particles alone, numerical computations are presented and discussed to illustrate how the method works in practice and the kind of information that can be extracted from it. Comments on the current modelling state and propositions for future investigations which try to link the present work with other ideas in physics are made at the end of the paper.

Arctic tundra shrub invasion and soot deposition: Consequences for spring snowmelt and near-surface air temperatures

Science.gov (United States)

Strack, John E.; Pielke, Roger A.; Liston, Glen E.

2007-12-01

Invasive shrubs and soot pollution both have the potential to alter the surface energy balance and timing of snow melt in the Arctic. Shrubs reduce the amount of snow lost to sublimation on the tundra during the winter leading to a deeper end-of-winter snowpack. The shrubs also enhance the absorption of energy by the snowpack during the melt season by converting incoming solar radiation to longwave radiation and sensible heat. Soot deposition lowers the albedo of the snow, allowing it to more effectively absorb incoming solar radiation and thus melt faster. This study uses the Colorado State University Regional Atmospheric Modeling System version 4.4 (CSU-RAMS 4.4), equipped with an enhanced snow model, to investigate the effects of shrub encroachment and soot deposition on the atmosphere and snowpack in the Kuparuk Basin of Alaska during the May-June melt period. The results of the simulations suggest that a complete invasion of the tundra by shrubs leads to a 2.2°C warming of 3 m air temperatures and a 108 m increase in boundary layer depth during the melt period. The snow-free date also occurred 11 d earlier despite having a larger initial snowpack. The results also show that a decrease in the snow albedo of 0.1, owing to soot pollution, caused the snow-free date to occur 5 d earlier. The soot pollution caused a 1.0°C warming of 3 m air temperatures and a 25 m average deepening of the boundary layer.

A comparative study on the sooting tendencies of various 1-alkene fuels in counterflow diffusion flames

KAUST Repository

Wang, Yu

2018-02-19

Alkenes are important components in transportation fuels, and are known to have increased sooting tendencies compared to analogous saturated hydrocarbons with the same carbon number. This work aims to understand the sooting tendencies of various 1-alkenes through experiments and numerical simulations for counterflow diffusion flames. Soot and PAH formation tendencies of 1-alkene fuels, including ethylene (C2H4), propene (C3H6), 1-butene (1-C4H8), 1-pentene (1-C5H10), 1-hexene (1-C6H12) and 1-octene (1-C8H16), were experimentally studied using laser induced-incandescence (LII) and laser-induced fluorescence (LIF) techniques, respectively. From the LII results, 1-C4H8 was found to be the most sooting fuel, followed by C3H6 > 1-C5H10 > 1-C6H12 > 1-C8H16 > C2H4. The LIF data with a detection wavelength of 500 nm indicated the PAH formation tendencies followed the order of 1-C4H8 > 1-C5H10 ∼1-C6H12 > C3H6 > 1-C8H16 > C2H4, which were different from the order of sooting tendencies. Numerical simulations with a comprehensive chemical kinetic model including PAH growth chemistry for the tested 1-alkene fuels were conducted to elucidate the aromatic formation pathways and rationalize the experimentally observed trends. The numerical results highlighted the importance of intermediate species with odd carbon numbers in aromatic species formation, such as propargyl, allyl, cyclopentadienyl and indenyl radicals. Their concentration differences, which could be traced back to the parent fuel molecules through rate of production analysis, rationalize the experimentally observed differences in soot and PAH formation tendencies.

Impact of intake CO 2 addition and exhaust gas recirculation on NO x emissions and soot reactivity in a common rail diesel engine

KAUST Repository

Al-Qurashi, Khalid

2012-10-18

The impact of intake CO 2 addition and exhaust gas recirculation (EGR) on engine combustion characteristics, NO x emissions, and soot oxidative reactivity was studied in a common rail diesel engine equipped with a cooled EGR system. The engine test results and the heat release analysis show that the reduced flame temperature, induced by the reduction of the oxygen concentration (dilution effect) is the dominant mechanism via which CO 2 and EGR lower NO x emissions in diesel engines. On the other hand, the collected soot from the engine tests was examined for its oxidative reactivity using a thermogravimetric analyzer (TGA). Results show that EGR has a significant effect on soot reactivity and results in higher initial active sites compared to the CO 2 case. We conclude that the reduced flame temperature (thermal effect) which is a consequence of the dilution effect is responsible for the observed increase in soot reactivity. These results confirm observations from our past work on flame soot, which showed that the peak adiabatic flame temperature is the governing factor affecting soot reactivity. These findings imply that driving the combustion concepts toward low temperature is favorable to effectively control engine pollutants, including soot reactivity. © 2012 American Chemical Society.

Impact of intake CO 2 addition and exhaust gas recirculation on NO x emissions and soot reactivity in a common rail diesel engine

KAUST Repository

Al-Qurashi, Khalid; Zhang, Yu; Boehman, André Louis

2012-01-01

The impact of intake CO 2 addition and exhaust gas recirculation (EGR) on engine combustion characteristics, NO x emissions, and soot oxidative reactivity was studied in a common rail diesel engine equipped with a cooled EGR system. The engine test results and the heat release analysis show that the reduced flame temperature, induced by the reduction of the oxygen concentration (dilution effect) is the dominant mechanism via which CO 2 and EGR lower NO x emissions in diesel engines. On the other hand, the collected soot from the engine tests was examined for its oxidative reactivity using a thermogravimetric analyzer (TGA). Results show that EGR has a significant effect on soot reactivity and results in higher initial active sites compared to the CO 2 case. We conclude that the reduced flame temperature (thermal effect) which is a consequence of the dilution effect is responsible for the observed increase in soot reactivity. These results confirm observations from our past work on flame soot, which showed that the peak adiabatic flame temperature is the governing factor affecting soot reactivity. These findings imply that driving the combustion concepts toward low temperature is favorable to effectively control engine pollutants, including soot reactivity. © 2012 American Chemical Society.

Assessment of cleaning efficiency of the polydisperse gas flow in double-flow dedusting system

Directory of Open Access Journals (Sweden)

O.G. Butenko

2016-05-01

Full Text Available One of priority problems of nature protection activity at the industrial enterprises is upgrading the gas emissions cleaning of polydispersed dust. To solve the problem of catching of small fraction dust the double-flow dedusting system has been offered. Aim: The aim of the work is to determine the dependency type of the cleaning efficiency of polydisperse gas flow on gas separation factor double-flow dedusting system. Materials and methods: The analysis of influence of gas separation factor in the dividing device of double-flow dedusting system on its efficiency is carried out. By drawing up the mass balance of system on gas and on the mass of dust the general dependence for breakthrough of the main catcher, characterizing overall effectiveness of system, is received. Results: It is shown that value of breakthrough factor of the main catcher depends on dimensionless efficiency factors of the equipment. The received general dependence of breakthrough factor on separation factor allows to define the optimum value of separation factor for any combined dedusting system.

Accurate Measurements of Aircraft Engine Soot Emissions Using a CAPS PMssa Monitor

Science.gov (United States)

Onasch, Timothy; Thompson, Kevin; Renbaum-Wolff, Lindsay; Smallwood, Greg; Make-Lye, Richard; Freedman, Andrew

2016-04-01

We present results of aircraft engine soot emissions measurements during the VARIAnT2 campaign using CAPS PMssa monitors. VARIAnT2, an aircraft engine non-volatile particulate matter (nvPM) emissions field campaign, was focused on understanding the variability in nvPM mass measurements using different measurement techniques and accounting for possible nvPM sampling system losses. The CAPS PMssa monitor accurately measures both the optical extinction and scattering (and thus single scattering albedo and absorption) of an extracted sample using the same sample volume for both measurements with a time resolution of 1 second and sensitivity of better than 1 Mm-1. Absorption is obtained by subtracting the scattering signal from the total extinction. Given that the single scattering albedo of the particulates emitted from the aircraft engine measured at both 630 and 660 nm was on the order of 0.1, any inaccuracy in the scattering measurement has little impact on the accuracy of the ddetermined absorption coefficient. The absorption is converted into nvPM mass using a documented Mass Absorption Coefficient (MAC). Results of soot emission indices (mass soot emitted per mass of fuel consumed) for a turbojet engine as a function of engine power will be presented and compared to results obtained using an EC/OC monitor.

The contribution of tyre and brake abrasion to soot levels in streets; Beitrag des Reifen- und Bremsenabriebs zur Russemission an Strassen

Energy Technology Data Exchange (ETDEWEB)

Rauterberg-Wulff, A.

1998-09-01

After the coming into force of the new soot emission thresholds as of July 1998, excess values are measured along many city streets. The author investigated whether tyre and brake abrasion contributes to soot emissions in addition to diesel soot. For this purpose, characteristic material and physical parameters of particles of diesel soot, tyre and brake material were investigated by thermography, AAS, and SEM. With the aid of a receptor-oriented approach, the contribution of these particles to soot levels measured in a highway tunnel and a Berlin city street could be assessed. The contribution of local traffic was calculated from the difference between soot levels along the road and in a background station. The measurements inside the tunnel served to determine emissin factors for diesel soot and abrasion particles from tyres and brakes. (orig.) [Deutsch] Mit Inkrafttreten des endgueltigen Russ-Immissionswertes der 23. Verordnung zum Bundes-Immissionsschutzgesetz im Juli 1998 ist an zahlreichen innerstaedtischen Strassen mit einer Ueberschreitung dieser Werte zu rechnen. Zur Beantwortung der Frage, inwieweit neben Dieselruss auch Reifen- und Bremsenabrieb zur verkehrsbedingten Russimmission beitragen, wurden charakteristische stoffliche und physikalische Eigenschaften von Dieselruss, Reifenabrieb und Bremsenabrieb mit der Thermographie, der AAS und der Rasterelektronenmikroskopie untersucht. Mit Hilfe dieses rezeptororientierten Ansatzes konnte der Beitrag dieser Partikel zur Russimmission in einem Autobahntunnel und an einer Hauptverkehrsstrasse in Berlin bestimmt werden, wobei zuerst der Beitrag des lokalen Verkehrs zur Russimmission aus der Differenz zwischen der Russimmission an der Strassen- und einer Hintergrundstation berechnet wurde. Mit Hilfe der Messungen im Tunnel konnten Emissionsfaktoren fuer Dieselruss und fuer Reifen- und Bremsenabriebpartikel bestimmt werden. (orig.)

Equilibrium-eulerian les model for turbulent poly-dispersed particle-laden flow

KAUST Repository

Icardi, Matteo; Marchisio, Daniele Luca; Chidambaram, Narayanan; Fox, Rodney O.

2013-01-01

An efficient Eulerian method for poly-dispersed particles in turbulent flows is implemented, verified and validated for a channel flow. The approach couples a mixture model with a quadrature-based moment method for the particle size distribution in a LES framework, augmented by an approximate deconvolution method to reconstructs the unfiltered velocity. The particle velocity conditioned on particle size is calculated with an equilibrium model, valid for low Stokes numbers. A population balance equation is solved with the direct quadrature method of moments, that efficiently represents the continuous particle size distribution. In this first study particulate processes are not considered and the capability of the model to properly describe particle transport is investigated for a turbulent channel flow. First, single-phase LES are validated through comparison with DNS. Then predictions for the two-phase system, with particles characterised by Stokes numbers ranging from 0.2 to 5, are compared with Lagrangian DNS in terms of particle velocity and accumulation at the walls. Since this phenomenon (turbophoresis) is driven by turbulent fluctuations and depends strongly on the particle Stokes number, the approximation of the particle size distribution, the choice of the sub-grid scale model and the use of an approximate deconvolution method are important to obtain good results. Our method can be considered as a fast and efficient alternative to classical Lagrangian methods or Eulerian multi-fluid models in which poly-dispersity is usually neglected.

Equilibrium-eulerian les model for turbulent poly-dispersed particle-laden flow

KAUST Repository

Icardi, Matteo

2013-04-01

An efficient Eulerian method for poly-dispersed particles in turbulent flows is implemented, verified and validated for a channel flow. The approach couples a mixture model with a quadrature-based moment method for the particle size distribution in a LES framework, augmented by an approximate deconvolution method to reconstructs the unfiltered velocity. The particle velocity conditioned on particle size is calculated with an equilibrium model, valid for low Stokes numbers. A population balance equation is solved with the direct quadrature method of moments, that efficiently represents the continuous particle size distribution. In this first study particulate processes are not considered and the capability of the model to properly describe particle transport is investigated for a turbulent channel flow. First, single-phase LES are validated through comparison with DNS. Then predictions for the two-phase system, with particles characterised by Stokes numbers ranging from 0.2 to 5, are compared with Lagrangian DNS in terms of particle velocity and accumulation at the walls. Since this phenomenon (turbophoresis) is driven by turbulent fluctuations and depends strongly on the particle Stokes number, the approximation of the particle size distribution, the choice of the sub-grid scale model and the use of an approximate deconvolution method are important to obtain good results. Our method can be considered as a fast and efficient alternative to classical Lagrangian methods or Eulerian multi-fluid models in which poly-dispersity is usually neglected.

Effects of soot formation on shape of a nonpremixed laminar flame established in a shear boundary layer in microgravity

International Nuclear Information System (INIS)

Wang, H Y; Merino, J L Florenciano; Dagaut, P

2011-01-01

A numerical study was performed to give a quantitative description of a heavily sooting, nonpremixed laminar flame established in a shear boundary layer in microgravity. Controlling mechanisms of three dimensional flow, combustion, soot and radiation are coupled. Soot volume fraction were predicted by using three approaches, referred respectively to as the fuel, acetylene and PAH inception models. It is found that the PAH inception model, which is based on the formation of two and three-ringed aromatic species, reproduces correctly the experimental data from a laminar ethylene diffusion flame. The PAH inception model serves later to better understand flame quenching, flame stand-off distance and soot formation as a function of the dimensionless volume coefficient, defined as C q = V F /V ox where V F is the fuel injection velocity, and V ox air stream velocity. The present experiments showed that a blue unstable flame, negligible radiative feedback, may change to a yellow stable flame, significant radiative loss with an increase of C q ; this experimental trend was numerically reproduced. The flame quenching occurs at the trailing edge due to radiative heat loss which is significantly amplified by increasing V F or decreasing V ox , favouring soot formation. Along a semi-infinite fuel zone, the ratio, d f /d b , where d f is the flame standoff distance, and d b the boundary layer thickness, converges towards a constant value of 1.2, while soot resides always within the boundary layer far away from the flame sheet.

Soot particle size measurements in ethylene diffusion flames at elevated pressures

KAUST Repository

Steinmetz, Scott; Fang, Tiegang; Roberts, William L.

2016-01-01

for the first time at elevated pressures. Soot volume fraction dependence on pressure is consistent with the observations of similar studies, scaling approximately with the square of pressure. Scattering intensity is analyzed through Rayleigh and Rayleigh

Atomic layer deposition of cerium oxide for potential use in diesel soot combustion

Energy Technology Data Exchange (ETDEWEB)

Ivanova, Tatiana V., E-mail: tatiana.ivanova@lut.fi, E-mail: ivanova.tatyana.v@gmail.com; Toivonen, Jenni; Maydannik, Philipp S.; Kääriäinen, Tommi; Sillanpää, Mika [ASTRaL Team, Laboratory of Green Chemistry, School of Engineering Science, Lappeenranta University of Technology, Sammonkatu 12, FI-50130 Mikkeli (Finland); Homola, Tomáš; Cameron, David C. [R& D Centre for Low-Cost Plasma and Nanotechnology Surface Modification, Masaryk University, Kotlářská 267/2, 611 37 Brno (Czech Republic)

2016-05-15

The particulate soot emission from diesel motors has a severe impact on the environment and people's health. The use of catalytic convertors is one of the ways to minimize the emission and decrease the hazard level. In this paper, the activity of cerium oxide for catalytic combustion of diesel soot was studied. Thin films of cerium dioxide were synthesized by atomic layer deposition using tetrakis(2,2,6,6-tetramethyl-3,5-heptanedionato)cerium [Ce(thd){sub 4}] and ozone as precursors. The characteristics of the films were studied as a function of deposition conditions within the reaction temperature range of 180–350 °C. Thickness, crystallinity, elemental composition, and morphology of the CeO{sub 2} films deposited on Si (100) were characterized by ellipsometry, x-ray diffraction, x-ray photoelectron spectroscopy, atomic force microscopy, and field emission scanning electron microscopy, respectively. The growth rate of CeO{sub 2} was observed to be 0.30 Å/cycle at temperatures up to 250 °C with a slight increase to 0.37 Å/cycle at 300 °C. The effect of CeO{sub 2} films grown on stainless steel foil supports on soot combustion was measured with annealing tests. Based on the analysis of these, in catalytic applications, CeO{sub 2} has been shown to be effective in lowering the soot combustion temperature from 600 °C for the uncoated substrates to 370 °C for the CeO{sub 2} coated ones. It was found that the higher deposition temperatures had a positive effect on the catalyst performance.

Equation of state and jamming density for equivalent bi- and polydisperse, smooth, hard sphere systems.

NARCIS (Netherlands)

Ogarko, V.; Luding, Stefan

2012-01-01

We study bi- and polydisperse mixtures of hard sphere fluids with extreme size ratios up to 100. Simulation results are compared with previously found analytical equations of state by looking at the compressibility factor, Z, and agreement is found with much better than 1% deviation in the fluid

Production of high-quality polydisperse construction mixes for additive 3D technologies.

Science.gov (United States)

Gerasimov, M. D.; Brazhnik, Yu V.; Gorshkov, P. S.; Latyshev, S. S.

2018-03-01

The paper describes a new design of a mixer allowing production of high quality polydisperse powders, used in additive 3D technologies. A new principle of dry powder particle mixing is considered, implementing a possibility of a close-to-ideal distribution of such particles in common space. A mathematical model of the mixer is presented, allowing evaluating quality indicators of the produced mixture. Experimental results are shown and rational values of process parameters of the mixer are obtained.

Extension of weighted sum of gray gas data to mathematical simulation of radiative heat transfer in a boiler with gas-soot media.

Science.gov (United States)

Gharehkhani, Samira; Nouri-Borujerdi, Ali; Kazi, Salim Newaz; Yarmand, Hooman

2014-01-01

In this study an expression for soot absorption coefficient is introduced to extend the weighted-sum-of-gray gases data to the furnace medium containing gas-soot mixture in a utility boiler 150 MWe. Heat transfer and temperature distribution of walls and within the furnace space are predicted by zone method technique. Analyses have been done considering both cases of presence and absence of soot particles at 100% load. To validate the proposed soot absorption coefficient, the expression is coupled with the Taylor and Foster's data as well as Truelove's data for CO2-H2O mixture and the total emissivities are calculated and compared with the Truelove's parameters for 3-term and 4-term gray gases plus two soot absorption coefficients. In addition, some experiments were conducted at 100% and 75% loads to measure furnace exit gas temperature as well as the rate of steam production. The predicted results show good agreement with the measured data at the power plant site.

Experimental and numerical investigation of fuel mixing effects on soot structures in counterflow diffusion flames

KAUST Repository

Choi, Byungchul

2011-03-26

Experimental and numerical analyses of laminar diffusion flames were performed to identify the effect of fuel mixing on soot formation in a counterflow burner. In this experiment, the volume fraction, number density, and particle size of soot were investigated using light extinction/scattering systems. The experimental results showed that the synergistic effect of an ethylene-propane flame is appreciable. Numerical simulations showed that the benzene (C6H6) concentration in mixture flames was higher than in ethylene-base flames because of the increase in the concentration of propargyl radicals. Methyl radicals were found to play an important role in the formation of propargyl, and the recombination of propargyl with benzene was found to lead to an increase in the number density for cases exhibiting synergistic effects. These results imply that methyl radicals play an important role in soot formation, particularly with regard to the number density. © 2011 The Korean Society of Automotive Engineers and Springer-Verlag Berlin Heidelberg.

Effect of soot on oil properties and wear of engine components

International Nuclear Information System (INIS)

Green, D A; Lewis, R

2007-01-01

The objective of the work outlined in this paper was to increase the understanding of the wear mechanisms that occur within a soot contaminated contact zone, to help in future development of a predictive wear model to assist in the automotive engine valve train design process. The paper builds on previous work by the author, through testing of different lubricants and increased levels of soot contamination. Wear testing has been carried out using specimens operating under realistic engine conditions, using a reciprocating test-rig specifically designed for this application, where a steel disc is held in a heated bath of oil and a steel ball is attached to a reciprocating arm (replicating a sliding elephant's foot valve train contact). Detailed analysis of the test specimens has been performed using scanning electron microscopy to identify wear features relating to the proposed wear mechanisms. Analysis of worn engine components from durability engine tests has also been carried out for a comparison between specimen tests and engine testing. To assist the understanding of the wear test results obtained, the physical properties of contaminated lubricants were investigated, through viscosity, traction and friction measurements. The results have revealed how varying lubrication conditions change the wear rate of engine components and determine the wear mechanism that dominates in specific situations. Testing has also shown the positive effects of advanced engine lubricants to reduce the amount of wear produced with soot present

Facile synthesis of nano cauliflower and nano broccoli like hierarchical superhydrophobic composite coating using PVDF/carbon soot particles via gelation technique.

Science.gov (United States)

Sahoo, Bichitra Nanda; Balasubramanian, Kandasubramanian

2014-12-15

We have elucidated a cost effective fabrication technique to produce superhydrophobic polyvinylidene fluoride (PVDF/DMF/candle soot particle and PVDF/DMF/camphor soot particle composite) porous materials. The water repellent dry composite was formed by the interaction of non-solvent (methanol) into PVDF/carbon soot particles suspension in N,N-dimethylformamide (DMF). It is seen that longer quenching time effectively changes the surface morphology of dry composites. The nano broccoli like hierarchical microstructure with micro or nano scaled roughen surface was obtained for PVDF/DMF/camphor soot particle, which reveals water contact angle of 172° with roll off angle of 2°. However, composite coating of PVDF/DMF/candle soot particle shows nano cauliflower like hierarchical, which illustrates water contact angle of 169° with roll off angle of 3°. To elucidate the enhancement of water repellent property of PVDF composites, we further divulge the evolution mechanism of nano cauliflower and nano broccoli structure. In order to evaluate the water contact angle of PVDF composites, surface diffusion of water inside the pores is investigated. Furthermore, the addition of small amount of carbon soot particles in composite not only provides the crystallization of PVDF, but also leads to dramatical amendment of surface morphology which increases the surface texture and roughness for superhydrophobicity. Copyright © 2014 Elsevier Inc. All rights reserved.

Generalized random sequential adsorption of polydisperse mixtures on a one-dimensional lattice

International Nuclear Information System (INIS)

Lončarević, I; Budinski-Petković, Lj; Vrhovac, S B; Belić, A

2010-01-01

Generalized random sequential adsorption (RSA) of polydisperse mixtures of k-mers on a one-dimensional lattice is studied numerically by means of Monte Carlo simulations. The kinetics of the deposition process of mixtures is studied for the irreversible case, for adsorption–desorption processes and for the case where adsorption, desorption and diffusion are present simultaneously. We concentrate here on the influence of the number of mixture components and the length of the k-mers making up the mixture on the temporal behavior of the coverage fraction θ(t). The approach of the coverage θ(t) to the jamming limit θ jam in the case of irreversible RSA is found to be exponential, θ jam -θ(t)∝ exp(-t/σ), not only for a whole mixture, but also for the individual components. For the reversible deposition of polydisperse mixtures, we find that after the initial 'jamming', a stretched exponential growth of the coverage θ(t) towards the equilibrium state value θ eq occurs, i.e., θ eq -θ(t)∝ exp[-(t/τ) β ]. The characteristic timescale τ is found to decrease with the desorption probability P des . When adsorption, desorption and diffusion occur simultaneously, the coverage of a mixture always reaches an equilibrium value θ eq , but there is a significant difference in temporal evolution between the coverage with diffusion and that without

Simulation of reactive polydisperse sprays strongly coupled to unsteady flows in solid rocket motors: Efficient strategy using Eulerian Multi-Fluid methods

Science.gov (United States)

Sibra, A.; Dupays, J.; Murrone, A.; Laurent, F.; Massot, M.

2017-06-01

In this paper, we tackle the issue of the accurate simulation of evaporating and reactive polydisperse sprays strongly coupled to unsteady gaseous flows. In solid propulsion, aluminum particles are included in the propellant to improve the global performances but the distributed combustion of these droplets in the chamber is suspected to be a driving mechanism of hydrodynamic and acoustic instabilities. The faithful prediction of two-phase interactions is a determining step for future solid rocket motor optimization. When looking at saving computational ressources as required for industrial applications, performing reliable simulations of two-phase flow instabilities appears as a challenge for both modeling and scientific computing. The size polydispersity, which conditions the droplet dynamics, is a key parameter that has to be accounted for. For moderately dense sprays, a kinetic approach based on a statistical point of view is particularly appropriate. The spray is described by a number density function and its evolution follows a Williams-Boltzmann transport equation. To solve it, we use Eulerian Multi-Fluid methods, based on a continuous discretization of the size phase space into sections, which offer an accurate treatment of the polydispersion. The objective of this paper is threefold: first to derive a new Two Size Moment Multi-Fluid model that is able to tackle evaporating polydisperse sprays at low cost while accurately describing the main driving mechanisms, second to develop a dedicated evaporation scheme to treat simultaneously mass, moment and energy exchanges with the gas and between the sections. Finally, to design a time splitting operator strategy respecting both reactive two-phase flow physics and cost/accuracy ratio required for industrial computations. Using a research code, we provide 0D validations of the new scheme before assessing the splitting technique's ability on a reference two-phase flow acoustic case. Implemented in the industrial

Effects of DME mixing on number density and size properties of soot particles in counterflow non-premixed ethylene flames

KAUST Repository

Choi, J. H.

2015-05-01

In order to investigate the effect of DME mixing on the number density and size of soot particles, DME was mixed in a counter flow non-premixed ethylene flame with mixture ratios of 5%, 14% and 30%. A laser extinction/scattering technique has been adopted to measure the volume fraction, number density, and mean size of soot particles. The experimental results showed that the highest soot concentrations were observed for flames with mixture ratios of 5% and 14%; however, for a mixture ratio of 30% the soot concentration decreased. Numerical results showed that the concentrations of propargyl radicals (C3H3) at the 5% and 14% ratios were higher than those measured in the ethylene-based flame, and the production of benzene (C6H6) in the 5% and 14% DME mixture flames was also increased. This indicates the crucial role of propargyl in benzene ring formation. These reactions generally become stronger with increased DME mixing, except for A1- + H2 → A1 + H (-R554) and n-C4H5 + C2H2 → A1 + H (R542). Therefore, it is indicated that adding DME to ethylene flames promotes benzene ring formation. Note that although the maximum C6H6 concentration is largest in the 30% DME mixing flame, the soot volume fraction is smaller than those for the 5% and 14% mixture ratios. This is because the local C6H6 concentration decreases in the relatively low temperature region in the fuel side where soot growth occurs. © 2015, The Korean Society of Mechanical Engineers and Springer-Verlag Berlin Heidelberg.

Effects of DME mixing on number density and size properties of soot particles in counterflow non-premixed ethylene flames

KAUST Repository

Choi, J. H.; Choi, B. C.; Lee, S. M.; Chung, Suk-Ho; Jung, K. S.; Jeong, W. L.; Choi, S. K.; Park, S. K.

2015-01-01

In order to investigate the effect of DME mixing on the number density and size of soot particles, DME was mixed in a counter flow non-premixed ethylene flame with mixture ratios of 5%, 14% and 30%. A laser extinction/scattering technique has been adopted to measure the volume fraction, number density, and mean size of soot particles. The experimental results showed that the highest soot concentrations were observed for flames with mixture ratios of 5% and 14%; however, for a mixture ratio of 30% the soot concentration decreased. Numerical results showed that the concentrations of propargyl radicals (C3H3) at the 5% and 14% ratios were higher than those measured in the ethylene-based flame, and the production of benzene (C6H6) in the 5% and 14% DME mixture flames was also increased. This indicates the crucial role of propargyl in benzene ring formation. These reactions generally become stronger with increased DME mixing, except for A1- + H2 → A1 + H (-R554) and n-C4H5 + C2H2 → A1 + H (R542). Therefore, it is indicated that adding DME to ethylene flames promotes benzene ring formation. Note that although the maximum C6H6 concentration is largest in the 30% DME mixing flame, the soot volume fraction is smaller than those for the 5% and 14% mixture ratios. This is because the local C6H6 concentration decreases in the relatively low temperature region in the fuel side where soot growth occurs. © 2015, The Korean Society of Mechanical Engineers and Springer-Verlag Berlin Heidelberg.

Laser-Induced Emissions Sensor for Soot Mass in Rocket Plumes, Phase I

Data.gov (United States)

National Aeronautics and Space Administration — A method is proposed to measure soot mass concentration non-intrusively from a distance in a rocket engine exhaust stream during ground tests using laser-induced...

Reaction mechanism for the free-edge oxidation of soot by O 2

KAUST Repository

Raj, Abhijeet

2012-11-01

The reaction pathways for the oxidation by O 2 of polycyclic aromatic hydrocarbons present in soot particles are investigated using density functional theory at B3LYP/6-311++G(d,p) level of theory. For this, pyrene radical (4-pyrenyl) is chosen as the model molecule, as most soot models present in the literature employ the reactions involving the conversion of 4-pyrenyl to 4-phenanthryl by O 2 and OH to account for soot oxidation. Several routes for the formation of CO and CO 2 are proposed. The addition of O 2 on a radical site to form a peroxyl radical is found to be barrierless and exothermic with reaction energy of 188kJ/mol. For the oxidation reaction to proceed further, three pathways are suggested, each of which involve the activation energies of 104, 167 and 115kJ/mol relative to the peroxyl radical. The effect of the presence of H atom on a carbon atom neighboring the radical site on the energetics of carbon oxidation is assessed. Those intermediate species formed during oxidation with seven-membered rings or with a phenolic group are found to be highly stable. The rate constants evaluated using transition state theory in the temperature range of 300-3000K for the reactions involved in the mechanism are provided. © 2012 The Combustion Institute.

Reaction mechanism for the free-edge oxidation of soot by O 2

KAUST Repository

Raj, Abhijeet; da Silva, Gabriel; Chung, Suk-Ho

2012-01-01

The reaction pathways for the oxidation by O 2 of polycyclic aromatic hydrocarbons present in soot particles are investigated using density functional theory at B3LYP/6-311++G(d,p) level of theory. For this, pyrene radical (4-pyrenyl) is chosen as the model molecule, as most soot models present in the literature employ the reactions involving the conversion of 4-pyrenyl to 4-phenanthryl by O 2 and OH to account for soot oxidation. Several routes for the formation of CO and CO 2 are proposed. The addition of O 2 on a radical site to form a peroxyl radical is found to be barrierless and exothermic with reaction energy of 188kJ/mol. For the oxidation reaction to proceed further, three pathways are suggested, each of which involve the activation energies of 104, 167 and 115kJ/mol relative to the peroxyl radical. The effect of the presence of H atom on a carbon atom neighboring the radical site on the energetics of carbon oxidation is assessed. Those intermediate species formed during oxidation with seven-membered rings or with a phenolic group are found to be highly stable. The rate constants evaluated using transition state theory in the temperature range of 300-3000K for the reactions involved in the mechanism are provided. © 2012 The Combustion Institute.

Size-resolved measurement of the mixing state of soot in the megacity Beijing, China: diurnal cycle, aging and parameterization

Directory of Open Access Journals (Sweden)

Y. F. Cheng

2012-05-01

Full Text Available Soot particles are the most efficient light absorbing aerosol species in the atmosphere, playing an important role as a driver of global warming. Their climate effects strongly depend on their mixing state, which significantly changes their light absorbing capability and cloud condensation nuclei (CCN activity. Therefore, knowledge about the mixing state of soot and its aging mechanism becomes an important topic in the atmospheric sciences.

The size-resolved (30–320 nm diameter mixing state of soot particles in polluted megacity air was measured at a suburban site (Yufa during the CAREBeijing 2006 campaign in Beijing, using a volatility tandem differential mobility analyzer (VTDMA. Particles in this size range with non-volatile residuals at 300 °C were considered to be soot particles. On average, the number fraction of internally mixed soot in total soot particles (F_in, decreased from 0.80 to 0.57 when initial D_p increased from 30 to 320 nm. Further analysis reveals that: (1 F_in was well correlated with the aerosol hygroscopic mixing state measured by a CCN counter. More externally mixed soot particles were observed when particles showed more heterogeneous features with regard to hygroscopicity. (2 F_in had pronounced diurnal cycles. For particles in the accumulation mode (D_p at 100–320 nm, largest F_in were observed at noon time, with "apparent" turnover rates (k_{ex → in} up to 7.8% h⁻¹. (3 F_in was subject to competing effects of both aging and emissions. While aging increases F_in by converting externally mixed soot particles into internally mixed ones, emissions tend to reduce F_in by emitting more fresh and externally mixed soot particles. Similar competing effects were also found with air mass age indicators. (4 Under the estimated emission

Oxidation kinetics and soot formation

Science.gov (United States)

Glassman, I.; Brezinsky, K.

1983-01-01

The research objective is to clarify the role of aromaticity in the soot nucleation process by determining the relative importance of phenyl radical/molecular oxygen and benzene/atomic oxygen reactions in the complex combustion of aromatic compounds. Three sets of chemical flow reactor experiments have been designed to determine the relative importance of the phenyl radical/molecular oxygen and benzene/atomic oxygen reactions. The essential elements of these experiments are 1) the use of cresols and anisole formed during the high temperature oxidation of toluene as chemical reaction indicators; 2) the in situ photolysis of molecular oxygen to provide an oxygen atom perturbation in the reacting aromatic system; and 3) the high temperature pyrolysis of phenol, the cresols and possibly anisole.

Soot formation in a blast furnace - Prediction via a parametric study, using detailed kinetic modeling

Energy Technology Data Exchange (ETDEWEB)

Nordstroem, T.; Kilpinen, P.; Hupa, M. [Aabo Akademi, Turku (Finland). Combustion Chemistry Group

1996-12-31

The objective of this work has been to investigate the soot formation in a blast furnace fired with heavy fuel oil, using detailed kinetic modelling. This work has been concentrated on parameter studies that could explain under which conditions soot is formed and how that formation could be avoided. The parameters investigated were temperature, pressure, stoichiometric ratio, pyrolysis gas composition and reactor model. The calculations were based on a reaction mechanism that consists of 100 species and 446 reactions including polyaromatic hydrocarbons (PAM) up to 7 aromatic rings SULA 2 Research Programme; 4 refs.

Soot formation in a blast furnace - Prediction via a parametric study, using detailed kinetic modeling

Energy Technology Data Exchange (ETDEWEB)

Nordstroem, T; Kilpinen, P; Hupa, M [Aabo Akademi, Turku (Finland). Combustion Chemistry Group

1997-12-31

The objective of this work has been to investigate the soot formation in a blast furnace fired with heavy fuel oil, using detailed kinetic modelling. This work has been concentrated on parameter studies that could explain under which conditions soot is formed and how that formation could be avoided. The parameters investigated were temperature, pressure, stoichiometric ratio, pyrolysis gas composition and reactor model. The calculations were based on a reaction mechanism that consists of 100 species and 446 reactions including polyaromatic hydrocarbons (PAM) up to 7 aromatic rings SULA 2 Research Programme; 4 refs.

Continuum percolation of polydisperse rods in quadrupole fields: Theory and simulations

Science.gov (United States)

Finner, Shari P.; Kotsev, Mihail I.; Miller, Mark A.; van der Schoot, Paul

2018-01-01

We investigate percolation in mixtures of nanorods in the presence of external fields that align or disalign the particles with the field axis. Such conditions are found in the formulation and processing of nanocomposites, where the field may be electric, magnetic, or due to elongational flow. Our focus is on the effect of length polydispersity, which—in the absence of a field—is known to produce a percolation threshold that scales with the inverse weight average of the particle length. Using a model of non-interacting spherocylinders in conjunction with connectedness percolation theory, we show that a quadrupolar field always increases the percolation threshold and that the universal scaling with the inverse weight average no longer holds if the field couples to the particle length. Instead, the percolation threshold becomes a function of higher moments of the length distribution, where the order of the relevant moments crucially depends on the strength and type of field applied. The theoretical predictions compare well with the results of our Monte Carlo simulations, which eliminate finite size effects by exploiting the fact that the universal scaling of the wrapping probability function holds even in anisotropic systems. Theory and simulation demonstrate that the percolation threshold of a polydisperse mixture can be lower than that of the individual components, confirming recent work based on a mapping onto a Bethe lattice as well as earlier computer simulations involving dipole fields. Our work shows how the formulation of nanocomposites may be used to compensate for the adverse effects of aligning fields that are inevitable under practical manufacturing conditions.

Modelling the size and polydispersity of magnetic hybrid nanoparticles for luminescent sensing of oxygen

International Nuclear Information System (INIS)

Marín-Suárez, Marta; Arias-Martos, María C.; Fernández-Sánchez, Jorge F.; Fernández-Gutiérrez, Alberto; Galeano-Díaz, Teresa

2013-01-01

We report on a strategy to model both the size (d) and the polydispersity (PdI) of magnetic oxygen-sensitive nanoparticles with a typical size of 200 nm in order to increase the surface area. The strategy is based on experimental design and Response Surface Methodology. Nanoparticles were prepared by mini emulsion solvent evaporation of solutions of poly(styrene-co-maleic anhydride). Features of this strategy include (1) a quick selection of the most important variables that govern d and PdI; (2) a better understanding of the parameters that affect the performance of the polymer; and (3) optimized conditions for the synthesis of nanoparticles of targeted d and PdI. The results were used to produce nanoparticles in sizes that range from 100 to 300 nm and with small polydispersity. The addition of a platinum porphyrin complex that acts as a luminescent probe for oxygen and of magnetite (Fe 3 O 4 ) to the polymeric particles, did not affect d and PdI, thus demonstrating that this strategy simplifies their synthesis. The resulting luminescent and magnetic sensor nanoparticles respond to dissolved oxygen with sensitivity (Stern-Volmer constant) of around 35 bar −1 . (author)

Development of Kinetics for Soot Oxidation at High Pressures Under Fuel-Lean Conditions

Energy Technology Data Exchange (ETDEWEB)

Lighty, JoAnn [Univ. of Utah, Salt Lake City, UT (United States); Vander Wal, Randy [Pennsylvania State Univ., University Park, PA (United States)

2014-04-21

The focus of the proposed research was to develop kinetic models for soot oxidation with the hope of developing a validated, predictive, multi-­scale, combustion model to optimize the design and operation of evolving fuels in advanced engines for transportation applications. The work focused on the relatively unstudied area of the fundamental mechanism for soot oxidation. The objectives include understanding of the kinetics of soot oxidation by O2 under high pressure which require: 1) development of intrinsic kinetics for the surface oxidation, which takes into account the dependence of reactivity upon nanostructure and 2) evolution of nanostructure and its impact upon oxidation rate and 3) inclusion of internal surface area development and possible fragmentation resulting from pore development and /or surface oxidation. These objectives were explored for a variety of pure fuel components and surrogate fuels. This project was a joint effort between the University of Utah (UU) and Pennsylvania State University (Penn State). The work at the UU focuses on experimental studies using a two-­stage burner and a high- pressure thermogravimetric analyzer (TGA). Penn State provided HRTEM images and guidance in the fringe analysis algorithms and parameter quantification for the images. This report focuses on completion done under supplemental funding.

A small porous-plug burner for studies of combustion chemistry and soot formation

Science.gov (United States)

Campbell, M. F.; Schrader, P. E.; Catalano, A. L.; Johansson, K. O.; Bohlin, G. A.; Richards-Henderson, N. K.; Kliewer, C. J.; Michelsen, H. A.

2017-12-01

We have developed and built a small porous-plug burner based on the original McKenna burner design. The new burner generates a laminar premixed flat flame for use in studies of combustion chemistry and soot formation. The size is particularly relevant for space-constrained, synchrotron-based X-ray diagnostics. In this paper, we present details of the design, construction, operation, and supporting infrastructure for this burner, including engineering attributes that enable its small size. We also present data for charactering the flames produced by this burner. These data include temperature profiles for three premixed sooting ethylene/air flames (equivalence ratios of 1.5, 1.8, and 2.1); temperatures were recorded using direct one-dimensional coherent Raman imaging. We include calculated temperature profiles, and, for one of these ethylene/air flames, we show the carbon and hydrogen content of heavy hydrocarbon species measured using an aerosol mass spectrometer coupled with vacuum ultraviolet photoionization (VUV-AMS) and soot-volume-fraction measurements obtained using laser-induced incandescence. In addition, we provide calculated mole-fraction profiles of selected gas-phase species and characteristic profiles for seven mass peaks from AMS measurements. Using these experimental and calculated results, we discuss the differences between standard McKenna burners and the new miniature porous-plug burner introduced here.

Intake condition requirements for biodiesel modulated kinetic combustion concept to achieve a simultaneous NOx and soot removal

International Nuclear Information System (INIS)

Kim, Keunsoo; Oh, Seungmook; Lee, Yonggyu; Lee, Sunyoup; Kim, Junghwan

2015-01-01

Highlights: • MK LTC combustion was investigated under various intake conditions. • BD20 MK combustion achieved NO x and soot removal at achievable intake conditions. • The BD20 best point showed lower ISFC and COV IMEP than the diesel best point. • Higher intake pressure showed higher efficiency at all intake oxygen concentrations. • Simultaneous NO x and soot removal required 200 kPa intake pressure at a medium load. - Abstract: The fuel oxygen contained in oxygenated fuels can help reduce harmful engine-out emissions and improve the combustion process in compression-ignition engines. The use of soybean methylene ether biodiesel in the low-temperature combustion (LTC) regime has the potential to suppress soot formation and nitrogen oxides (NO x ) emissions even further, which eventually alleviates the burden of the after-treatment system. In the present study, the effects of the intake pressure and injection timing on the combustion and emissions of the modulated kinetic (MK) combustion concept with ultra-low sulfur diesel and 20% biodiesel blended fuel (BD20) were investigated in a single-cylinder CI engine. The intake pressure was varied from 100 kPa to 250 kPa for the intake oxygen concentration range of 11–17%. The engine test results indicate that simultaneous reductions in both the NO x and soot emissions were realized under the MK LTC combustion regime. At the best operating point, BD20 achieved the simultaneous NO x and soot removal at a lower intake pressure and lower EGR level than diesel, which led to better fuel economy. In addition, BD20 achieved acceptable levels of combustion stability and noise level

Aromatics oxidation and soot formation in flames

Energy Technology Data Exchange (ETDEWEB)

Howard, J.B.; Pope, C.J.; Shandross, R.A.; Yadav, T. [Massachusetts Institute of Technology, Cambridge (United States)

1993-12-01

This project is concerned with the kinetics and mechanisms of aromatics oxidation and soot and fullerenes formation in flames. The scope includes detailed measurements of profiles of stable and radical species concentrations in low-pressure one-dimensional premixed flames. Intermediate species identifications and mole fractions, fluxes, and net reaction rates calculated from the measured profiles are used to test postulated reaction mechanisms. Particular objectives are to identify and to determine or confirm rate constants for the main benzene oxidation reactions in flames, and to characterize fullerenes and their formation mechanisms and kinetics.

Modeling photopolarimetric characteristics of comet dust as a polydisperse mixture of polyshaped rough spheroids

Science.gov (United States)

Kolokolova, L.; Das, H.; Dubovik, O.; Lapyonok, T.

2013-12-01

It is widely recognized now that the main component of comet dust is aggregated particles that consist of submicron grains. It is also well known that cometary dust obey a rather wide size distribution with abundant particles whose size reaches dozens of microns. However, numerous attempts of computer simulation of light scattering by comet dust using aggregated particles have not succeeded to consider particles larger than a couple of microns due to limitations in the memory and speed of available computers. Attempts to substitute aggregates by polydisperse solid particles (spheres, spheroids, cylinders) could not consistently reproduce observed angular and spectral characteristics of comet brightness and polarization even in such a general case as polyshaped (i.e. containing particles of a variety of aspect ratios) mixture of spheroids (Kolokolova et al., In: Photopolarimetry in Remote Sensing, Kluwer Acad. Publ., 431, 2004). In this study we are checking how well cometary dust can be modeled using modeling tools for rough spheroids. With this purpose we use the software package described in Dubovik et al. (J. Geophys. Res., 111, D11208, doi:10.1029/2005JD006619d, 2006) that allows for a substantial reduction of computer time in calculating scattering properties of spheroid mixtures by means of using pre-calculated kernels - quadrature coefficients employed in the numerical integration of spheroid optical properties over size and shape. The kernels were pre-calculated for spheroids of 25 axis ratios, ranging from 0.3 to 3, and 42 size bins within the size parameter range 0.01 - 625. This software package has been recently expanded with the possibility of simulating not only smooth but also rough spheroids that is used in present study. We consider refractive indexes of the materials typical for comet dust: silicate, carbon, organics, and their mixtures. We also consider porous particles accounting on voids in the spheroids through effective medium approach. The

Dynamics of flow–soot interaction in wrinkled non-premixed ethylene–air flames

KAUST Repository

Arias, Paul G.; Lecoustre, Vivien R.; Roy, Somesh; Luo, Zhaoyu; Haworth, Daniel C.; Lu, Tianfeng; Trouvé , Arnaud; Im, Hong G.

2015-01-01

A two-dimensional simulation of a non-premixed ethylene–air flame was conducted by employing a detailed gas-phase reaction mechanism considering polycyclic aromatic hydrocarbons, an aerosol-dynamics-based soot model using a method of moments

Modeling polydispersive ensembles of diamond nanoparticles

International Nuclear Information System (INIS)

Barnard, Amanda S

2013-01-01

While significant progress has been made toward production of monodispersed samples of a variety of nanoparticles, in cases such as diamond nanoparticles (nanodiamonds) a significant degree of polydispersivity persists, so scaling-up of laboratory applications to industrial levels has its challenges. In many cases, however, monodispersivity is not essential for reliable application, provided that the inevitable uncertainties are just as predictable as the functional properties. As computational methods of materials design are becoming more widespread, there is a growing need for robust methods for modeling ensembles of nanoparticles, that capture the structural complexity characteristic of real specimens. In this paper we present a simple statistical approach to modeling of ensembles of nanoparticles, and apply it to nanodiamond, based on sets of individual simulations that have been carefully selected to describe specific structural sources that are responsible for scattering of fundamental properties, and that are typically difficult to eliminate experimentally. For the purposes of demonstration we show how scattering in the Fermi energy and the electronic band gap are related to different structural variations (sources), and how these results can be combined strategically to yield statistically significant predictions of the properties of an entire ensemble of nanodiamonds, rather than merely one individual ‘model’ particle or a non-representative sub-set. (paper)

In-cylinder Combustion and Soot Evolution in the Transition from Conventional CI mode to PPC

KAUST Repository

An, Yanzhao

2018-01-09

The present study intends to explore the in-cylinder combustion and evolution of soot emission during the transition from conventional compression ignition (CI) combustion to partially premixed combustion (PPC) at low load conditions. In-cylinder combustion images and engine-out emissions were measured in an optical engine fueled with low octane heavy naphtha fuel (RON = 50). Full cycle engine simulations were performed using a three-dimensional computational fluid dynamics code CONVERGETM, coupled with gas phase chemical kinetics, turbulence, and particulate size mimic soot model. The simulations were performed under low load conditions (IMEP ~ 2 to 3 bar) at an engine speed of 1200 rpm. The start of injection (SOI) was advanced from late (-10 CAD aTDC) to early fuel injection timings (-40 CAD aTDC) to realize the combustion transition from CI combustion to PPC. The simulation results of combustion and emission are compared with the experimental results at both CI and PPC combustion modes. The results of the study show a typical low-temperature stratified lean combustion at PPC mode, while high-temperature spray-driven combustion is evident at CI mode. The in-cylinder small intermediates species such as acetylene (C2H2), propargyl (C3H3), cyclopentadienyl (C5H5) and polycyclic aromatic hydrocarbons (PAHs) were significantly suppressed at PPC mode. Nucleation reaction of PAHs collision contributed to main soot mass production. The distribution of soot mass and particle number density was consistent with the distribution of high-temperature zones at CI and PPC combustion modes.

Modelling soot formation from wall films in a gasoline direct injection engine using a detailed population balance model

International Nuclear Information System (INIS)

Wang, Buyu; Mosbach, Sebastian; Schmutzhard, Sebastian; Shuai, Shijin; Huang, Yaqing; Kraft, Markus

2016-01-01

Highlights: • Soot formation from a wall film in a GDI engine is simulated. • Spray impingement and wall film evaporation models are added to SRM Engine Suite. • Soot is modelled using a highly detailed population balance model. • Particle size distributions are measured experimentally. • Evolution of wall region is shown in equivalence ratio-temperature diagrams. - Abstract: In this study, soot formation in a Gasoline Direct Injection (GDI) engine is simulated using a Stochastic Reactor Model (SRM Engine Suite) which contains a detailed population balance soot model capable of describing particle morphology and chemical composition. In order to describe the soot formation originating from the wall film, the SRM Engine Suite is extended to include spray impingement and wall film evaporation models. The cylinder is divided into a wall and a bulk zone to resolve the equivalence ratio and temperature distributions of the mixture near the wall. The combustion chamber wall is assumed to exchange heat directly only with the wall zone. The turbulent mixing within each zone and between the two zones are simulated with different mixing models. The effects of key parameters on the temperature and equivalence ratio in the two zones are investigated. The mixing rate between the wall and bulk zone has a significant effect on the wall zone, whilst the mixing rate in the wall zone only has a negligible impact on the temperature and equivalence ratio below a certain threshold. Experimental data are obtained from a four-cylinder, gasoline-fuelled direct injection spark ignition engine operated stoichiometrically. An injection timing sweep, ranging from 120 CAD BTDC to 330 CAD BTDC, is conducted in order to investigate the effect of spray impingement on soot formation. The earliest injection case (330 CAD BTDC), which produces significantly higher levels of particle emissions than any other case, is simulated by the current model. It is found that the in-cylinder pressure

The concentration of heavy metals and PAH's in soot water - suggested methods of treatment; Halten av tungmetaller och PAH:er i sotvatten - foerslag paa behandlingsmetoder

Energy Technology Data Exchange (ETDEWEB)

Hall, Bjoern (TecNet Nordic AB, Goeteborg (SE))

2007-12-15

What we here call 'soot water' is a contaminated water from seasonal cleaning of the furnace and heating sections with water. Earlier, it was common to discharge this type of water directly to a recipient or to the municipal sewage plant. Today, with new, more restricted regulations, this is not accepted unless the concentrations of different substances is well documented and below official limits. The objective of this project has been to increase the knowledge of soot water from different types of combustion plants and suggest ways to handle/treat this water. The project started with a literature survey of soot water in the Swedish, English and German open literature. The next step was to perform analyses on soot water from combustion of waste, wood chips, wood chips/peat, bio oil and heavy fuel oil. It is very difficult to take a representative sample of soot water. It is especially the amount of particles in the water that may change. Since particles contains high levels of heavy metals, this may severely affect the concentrations of metals in the sample, if included in the analysis. Soot water contains very low concentrations of mercury. The concentrations of PAH is also close to or below the detection limit. On the other hand, all soot water analysed, contains enough concentrations of some metal, to make it unsuitable to be discharged directly to a recipient or drain. Four methods of water treatment have been examined for its capacity to treat soot water with regard to their capacity, operational and economical performance. The result is as follows: Chemical precipitation is the method that is judged to have the highest potential as long as the chlorides and sulphates can be discharged to the recipient or municipal waste plant. Reversed osmosis is judged less suitable for soot water since the water contains calcium, sulfates and carbonates that may clog the membranes. Evaporators is also judged to be of less interest for soot water due to its

Alumina supported Co-K-Mo based catalytic material for diesel soot oxidation

Czech Academy of Sciences Publication Activity Database

Dhakad, M.; Joshi, A.G.; Rayalu, S.; Tanwar, P.; Bassin, J.K.; Kumar, R.; Lokhande, S.; Šubrt, Jan; Mitsuhashi, T.; Labhsetwar, N.

2009-01-01

Roč. 52, 13-20 (2009), s. 2070-2075 ISSN 1022-5528 Institutional research plan: CEZ:AV0Z40320502 Keywords : soot oxidation * diesel particulate filter * catalyst carbon oxidation Subject RIV: CA - Inorganic Chemistry Impact factor: 2.379, year: 2009

TEM and HRTEM of Soot-in-oil particles and agglomerates from internal combustion engines

International Nuclear Information System (INIS)

Fay, M W; Rocca, A La; Shayler, P J

2014-01-01

Over time, the performance of lubricating oil in a diesel engine is affected by the build-up of carbon soot produced by the combustion process. TEM and HRTEM are commonly used to investigate the characteristics of individual and agglomerated particles from diesel exhaust, to understand the structure and distribution of the carbon sheets in the primary particles and the nanostructure morphology. However, high resolution imaging of soot-in-oil is more challenging, as mineral oil is a contaminant for the electron microscope and leads to instability under the electron beam. In this work we compare solvent extraction and centrifugation techniques for removing the mineral oil contaminant, and the effect on particle size distribution

A poly-dispersed particle system representation of the porosity for non-saturated cementitious materials

International Nuclear Information System (INIS)

Bary, B.

2006-01-01

In this paper, the porosity of cementitious materials is described in terms of pore size distribution by means of a 3-dimensional overlapping sphere system with poly-dispersivity in size. On the basis of results established by Lu and Torquato [B. Lu, S. Torquato, Nearest-surface distribution functions for poly-dispersed particle systems, Phys. Rev. A 45(8) (1992) 5530-5544] and Torquato [S. Torquato, Random Heterogeneous Media: Microstructure and Macroscopic Properties. Springer-Verlag: New York, 2001] providing relations for nearest-neighbor distribution functions, the volume fraction of pores having a radius larger than a prescribed value is explicitly expressed. By adopting an appropriate size distribution function for the sphere system, it is shown that the pore size distribution of cementitious materials as detected for instance by mercury intrusion porosimetry (MIP), which generally points out several pore classes, can be well approached. On the basis of this porosity representation, the evaluation of the capillary pressure in function of the saturation degree is provided. The model is then applied to the simulation of the saturation degree versus relative humidity adsorption curves. The impact of the pore size distribution, the temperature and the thickness of the adsorbed water layer on these parameters are assessed and analyzed for three model materials having different pore characteristics. (author)

Intrinsic speckle noise in in-line particle holography due to polydisperse and continuous particle sizes

Science.gov (United States)

Edwards, Philip J.; Hobson, Peter R.; Rodgers, G. J.

2000-08-01

In-line particle holography is subject to image deterioration due to intrinsic speckle noise. The resulting reduction in the signal to noise ratio (SNR) of the replayed image can become critical for applications such as holographic particle velocimetry (HPV) and 3D visualisation of marine plankton. Work has been done to extend the mono-disperse model relevant to HPV to include poly-disperse particle fields appropriate for the visualisation of marine plankton. Continuous and discrete particle fields are both considered. It is found that random walk statistics still apply for the poly-disperse case. The speckle field is simply the summation of the individual speckle patters due to each scatter size. Therefor the characteristic speckle parameter (which encompasses particle diameter, concentration and sample depth) is alos just the summation of the individual speckle parameters. This reduces the SNR calculation to the same form as for the mono-disperse case. For the continuous situation three distributions, power, exponential and Gaussian are discussed with the resulting SNR calcuated. The work presented here was performed as part of the Holomar project to produce a working underwater holographic camera for recording plankton.

A computational study of radiation and gravity effect on temperature and soot formation in a methane air co-flow diffusion flame

Energy Technology Data Exchange (ETDEWEB)

Bhowal, Arup Jyoti, E-mail: arupjyoti.bhowal@heritageit.edu [Department of Mechanical Engineering, Heritage Institute of Technology, Chowbaga Road, Anandapur, Kolkata-700 107, West Bengal (India); Mandal, Bijan Kumar, E-mail: bkm375@yahoo.co.in [Department of Mechanical Engineering, Indian Institute of Engineering Science and Technology, Shibpur, Howrah – 711103, West Bengal (India)

2016-07-12

An effort has been made for a quantitative assessment of the soot formed under steady state in a methane air co flow diffusion flame by a numerical simulation at normal gravity and at lower gravity levels of 0.5 G, 0.1 G and 0.0001 G (microgravity). The peak temperature at microgravity is reduced by about 50 K than that at normal gravity level. There is an augmentation of soot formation at lower gravity levels. Peak value at microgravity multiplies by a factor of ∼7 of that at normal gravity. However, if radiation is not considered, soot formation is found to be much more.

NAA of an iridium tracer to determine soot exposure of students commuting on Baltimore`s buses

Energy Technology Data Exchange (ETDEWEB)

Ondov, J.M.; Wu, C.C.; Lin, Zhibo; Kidwell, C.B. [Univ. of Maryland, College Park, MD (United States)

1997-12-01

Epidemiologic studies suggest that short-term increases in indices of particulate air pollution are associated with increased mortality and morbidity from respiratory and cardiovascular diseases. An important component of urban aerosol, diesel soot, is a known respiratory irritant and contains mutagenic and carcinogenic organic compounds. In the United States, motor vehicles are thought to be the largest single source of atmospheric soot and account for {approximately}36% of the annual anthropogenic emission of toxic polynuclear aromatic hydrocarbons (PAH). Much of the motor-vehicle-derived PAH originates from diesel-powered vehicles because their PAH emissions are up to 50-fold greater than those from gasoline engines. In Baltimore, city high school students take public buses to school and, often, must stand at bus stops while many diesel buses pass or stop before their own buses arrive. To estimate student exposures to soot emitted from public diesel buses (MTA) during commutes to city high schools, the Baltimore municipal fuel supply was tagged with an iridium tracer, and exposure was monitored during commutes with personal aerosol monitors as a part of the Baltimore Environmental Justice Project.

Collision Statistics of Driven Polydisperse Granular Gases

International Nuclear Information System (INIS)

Chen Zhiyuan; Zhang Duanming; Yang Fengxia; Guo Xinping; Li Zhongming

2008-01-01

We present a dynamical model of two-dimensional polydisperse granular gases with fractal size distribution, in which the disks are subject to inelastic mutual collisions and driven by standard white noise. The inhomogeneity of the disk size distribution can be measured by a fractal dimension d f . By Monte Carlo simulations, we have mainly investigated the effect of the inhomogeneity on the statistical properties of the system in the same inelasticity case. Some novel results are found that the average energy of the system decays exponentially with a tendency to achieve a stable asymptotic value, and the system finally reaches a nonequilibrium steady state after a long evolution time. Furthermore, the inhomogeneity has great influence on the steady-state statistical properties. With the increase of the fractal dimension d f , the distributions of path lengths and free times between collisions deviate more obviously from expected theoretical forms for elastic spheres and have an overpopulation of short distances and time bins. The collision rate increases with d f , but it is independent of time. Meanwhile, the velocity distribution deviates more strongly from the Gaussian one, but does not demonstrate any apparent universal behavior

Effects of several types of biomass fuels on the yield, nanostructure and reactivity of soot from fast pyrolysis at high temperatures

DEFF Research Database (Denmark)

Trubetskaya, Anna; Jensen, Peter Arendt; Jensen, Anker Degn

2016-01-01

This study presents the effect of biomass origin on the yield, nanostructure and reactivity of soot. Soot was produced from wood and herbaceous biomass pyrolysis at high heating rates and at temperatures of 1250 and 1400 °C in a drop tube furnace. The structure of solid residues was characterized...

Time-averaged probability density functions of soot nanoparticles along the centerline of a piloted turbulent diffusion flame using a scanning mobility particle sizer

KAUST Repository

Chowdhury, Snehaunshu

2017-01-23

In this study, we demonstrate the use of a scanning mobility particle sizer (SMPS) as an effective tool to measure the probability density functions (PDFs) of soot nanoparticles in turbulent flames. Time-averaged soot PDFs necessary for validating existing soot models are reported at intervals of ∆x/D∆x/D = 5 along the centerline of turbulent, non-premixed, C2H4/N2 flames. The jet exit Reynolds numbers of the flames investigated were 10,000 and 20,000. A simplified burner geometry based on a published design was chosen to aid modelers. Soot was sampled directly from the flame using a sampling probe with a 0.5-mm diameter orifice and diluted with N2 by a two-stage dilution process. The overall dilution ratio was not evaluated. An SMPS system was used to analyze soot particle concentrations in the diluted samples. Sampling conditions were optimized over a wide range of dilution ratios to eliminate the effect of agglomeration in the sampling probe. Two differential mobility analyzers (DMAs) with different size ranges were used separately in the SMPS measurements to characterize the entire size range of particles. In both flames, the PDFs were found to be mono-modal in nature near the jet exit. Further downstream, the profiles were flatter with a fall-off at larger particle diameters. The geometric mean of the soot size distributions was less than 10 nm for all cases and increased monotonically with axial distance in both flames.

Time-averaged probability density functions of soot nanoparticles along the centerline of a piloted turbulent diffusion flame using a scanning mobility particle sizer

KAUST Repository

Chowdhury, Snehaunshu; Boyette, Wesley; Roberts, William L.

2017-01-01

In this study, we demonstrate the use of a scanning mobility particle sizer (SMPS) as an effective tool to measure the probability density functions (PDFs) of soot nanoparticles in turbulent flames. Time-averaged soot PDFs necessary for validating

The initial magnetic susceptibility of polydisperse ferrofluids: A comparison between experiment and theory over a wide range of concentration

International Nuclear Information System (INIS)

Solovyova, Anna Y.; Goldina, Olga A.; Ivanov, Alexey O.; Elfimova, Ekaterina A.; Lebedev, Aleksandr V.

2016-01-01

Temperature dependencies of the static initial magnetic susceptibility for ferrofluids at various concentrations are studied using experiment and statistical-mechanical theories. Magnetic susceptibility measurements are carried out for twelve samples of magnetite-based fluids stabilized with oleic acid over a wide range of temperatures (210 K ≲T ≲ 390 K); all samples have the same granulometric composition but different volume ferroparticle concentrations (0.2 ≲ φ ≲ 0.5). Experimental results are analyzed using three theories: the second-order modified mean-field theory (MMF2) [A. O. Ivanov and O. B. Kuznetsova, Phys. Rev. E 64, 41405 (2001)]; its correction for polydisperse ferrofluids arising from Mayer-type cluster expansion and taking into account the first terms of the polydisperse second virial coefficient [A. O. Ivanov and E. A. Elfimova, J. Magn. Magn. Mater 374, 327 (2015)]; and a new theory based on MMF2 combined with the first terms of the polydisperse second and third virial contributions to susceptibility. It turns out that the applicability of each theory depends on the experimental sample density. If twelve ferrofluid samples are split into three groups of strong, moderate, and low concentrated fluids, the temperature dependences of the initial magnetic susceptibility in each group are very precisely described by one of the three theories mentioned above. The determination of a universal formula predicting a ferrofluid susceptibility over a broad range of concentrations and temperatures remains as a challenge.

Influence of turbulence-chemistry interaction for n-heptane spray combustion under diesel engine conditions with emphasis on soot formation and oxidation

Science.gov (United States)

Bolla, Michele; Farrace, Daniele; Wright, Yuri M.; Boulouchos, Konstantinos; Mastorakos, Epaminondas

2014-03-01

The influence of the turbulence-chemistry interaction (TCI) for n-heptane sprays under diesel engine conditions has been investigated by means of computational fluid dynamics (CFD) simulations. The conditional moment closure approach, which has been previously validated thoroughly for such flows, and the homogeneous reactor (i.e. no turbulent combustion model) approach have been compared, in view of the recent resurgence of the latter approaches for diesel engine CFD. Experimental data available from a constant-volume combustion chamber have been used for model validation purposes for a broad range of conditions including variations in ambient oxygen (8-21% by vol.), ambient temperature (900 and 1000 K) and ambient density (14.8 and 30 kg/m3). The results from both numerical approaches have been compared to the experimental values of ignition delay (ID), flame lift-off length (LOL), and soot volume fraction distributions. TCI was found to have a weak influence on ignition delay for the conditions simulated, attributed to the low values of the scalar dissipation relative to the critical value above which auto-ignition does not occur. In contrast, the flame LOL was considerably affected, in particular at low oxygen concentrations. Quasi-steady soot formation was similar; however, pronounced differences in soot oxidation behaviour are reported. The differences were further emphasised for a case with short injection duration: in such conditions, TCI was found to play a major role concerning the soot oxidation behaviour because of the importance of soot-oxidiser structure in mixture fraction space. Neglecting TCI leads to a strong over-estimation of soot oxidation after the end of injection. The results suggest that for some engines, and for some phenomena, the neglect of turbulent fluctuations may lead to predictions of acceptable engineering accuracy, but that a proper turbulent combustion model is needed for more reliable results.

CFD studies of soot production in a coflow laminar diffusion flame under conditions of micro-gravity in fire safety

Directory of Open Access Journals (Sweden)

Arnaud Mbainguebem

2017-07-01

Full Text Available This work which is in the fire safety framework is focused on a numerical study of the production of soot in a laminar diffusion flame, under different conditions of micro-gravity in unsteady regime. It is intended to evaluate the temperature and rate at which the production of soot is predominant, to quantify their concentrations and volume fraction in dispersion. It has been accomplished by modification of the ReactingFOAM application source code of the OpenFOAM-2.3.0 by introducing for the first time, the equations of concentration transport and of volume fractions of soot. The results of the different values of gravity obtained are compared with the normal value of gravity and we ascertain that the results obtained were satisfactory and show the ability of the code to predict the speed and temperature of the formation of soot, their concentrations and their volume fractions. The maximum peak of the volume fraction varies from 7 × 10−8 to 4.5 × 10−6. The maximum temperature, which was 2423 K before changing the code, is about 2410 K after implementation of our modifications due to the taking into account of the numerical model.

Structure-reactivity correlation of diesel soot and characterization of polycyclic aromatic hydrocarbons and carbonyls in biofuel emissions; Struktur-Reaktivitaets-Korrelation von Dieselruss und Charakterisierung von PAHs und Carbonylen im Abgas von Biokraftstoffen

Energy Technology Data Exchange (ETDEWEB)

Knauer, Markus

2010-12-29

This work reports on the determination of the structure-reactivity correlation of soot using Raman microscopy (RM) and temperature programmed oxidation (TPO), as well as on changes in the emission level of polycyclic aromatic hydrocarbons (PAH) and carbonyls at the combustion of biofuels. To characterize the reactivity of soot the combustion behaviour of model- and diesel soot has been determined by means of TPO in the presence of oxygen. In this context, spark-discharge soot and graphite powder were applied as model substances, and EURO VI and IV diesel soot as real-diesel soots. The structure of soot samples was investigated by RM and structural changes during the TPO were observed. In order to make a statement about the changes in PAH and carbonyl compound emissions during combustion of biofuels, samples were taken at different engine testbenches. Fossil fuel, biodiesel and vegetable oil were used during this study, as well as fuel mixtures with different biofuel fractions.

Structure-reactivity correlation of diesel soot and characterization of polycyclic aromatic hydrocarbons and carbonyls in biofuel emissions; Struktur-Reaktivitaets-Korrelation von Dieselruss und Charakterisierung von PAHs und Carbonylen im Abgas von Biokraftstoffen

Energy Technology Data Exchange (ETDEWEB)

Knauer, Markus

2009-12-29

This work reports on the determination of the structure-reactivity correlation of soot using Raman microscopy (RM) and temperature programmed oxidation (TPO), as well as on changes in the emission level of polycyclic aromatic hydrocarbons (PAH) and carbonyls at the combustion of biofuels. To characterize the reactivity of soot the combustion behaviour of model- and diesel soot has been determined by means of TPO in the presence of oxygen. In this context, spark-discharge soot and graphite powder were applied as model substances, and EURO VI and IV diesel soot as real-diesel soots. The structure of soot samples was investigated by RM and structural changes during the TPO were observed. In order to make a statement about the changes in PAH and carbonyl compound emissions during combustion of biofuels, samples were taken at different engine testbenches. Fossil fuel, biodiesel and vegetable oil were used during this study, as well as fuel mixtures with different biofuel fractions.

Diesel/biodiesel soot oxidation with ceo2 and ceo2-zro2-modified cordierites: a facile way of accounting for their catalytic ability in fuel combustion processes

Directory of Open Access Journals (Sweden)

Rodrigo F. Silva

2011-01-01

Full Text Available CeO2 and mixed CeO2-ZrO2 nanopowders were synthesized and efficiently deposited onto cordierite substrates, with the evaluation of their morphologic and structural properties through XRD, SEM, and FTIR. The modified substrates were employed as outer heterogeneous catalysts for reducing the soot originated from the diesel and diesel/biodiesel blends incomplete combustion. Their activity was evaluated in a diesel stationary motor, and a comparative analysis of the soot emission was carried out through diffuse reflectance spectroscopy. The analyses have shown that the catalyst-impregnated cordierite samples are very efficient for soot oxidation, being capable of reducing the soot emission in more than 60%.

The Ångström Exponent and Turbidity of Soot Component in the ...

African Journals Online (AJOL)

OPAC) using FORTRAN program to model the effect of soot on optical depth, scattering coefficient, absorption coefficient, single scattering albedo, extinction coefficient and asymmetry parameter at spectral range of 0.25 to 1.00 ƒÝm for eight ...

Soot and chemiluminescence in diesel combustion of bio-derived, oxygenated and reference fuels

NARCIS (Netherlands)

Klein-Douwel, R.J.H.; Donkerbroek, A.J.; Vliet, A.P. van; Boot, M.D.; Somers, L.M.T.; Baert, R.S.G.; Dam, N.J.; Meulen, J.J. ter

2009-01-01

High-speed imaging, spectroscopy and thermodynamical characterization are applied to an optically accessible, heavy-duty diesel engine in order to compare sooting and chemiluminescence behaviour of bio-derived, oxygenated fuels and various reference fuels. The fuels concerned include the bio-derived

Chemical composition and heterogeneous reactivity of soot generated in the combustion of diesel and GTL (Gas-to-Liquid) fuels and amorphous carbon Printex U with NO2 and CF3COOH gases

Science.gov (United States)

Tapia, A.; Salgado, S.; Martín, P.; Villanueva, F.; García-Contreras, R.; Cabañas, B.

2018-03-01

The heterogeneous reactions of nitrogen dioxide (NO2) and trifluoroacetic acid (CF3COOH) with soot produced by diesel and GTL (gas-to-liquid) fuels were investigated using a Knudsen flow reactor with mass spectrometry as a detection system for gas phase species. Soot was generated with a 4 cylinder diesel engine working under steady-state like urban operation mode. Heterogeneous reaction of the mentioned gases with a commercial carbon, Printex U, used as reference, was also analyzed. The initial and the steady-state uptake coefficients, γ0 and γss, respectively, were measured indicating that GTL soot reacts faster than diesel soot and Printex U carbon for NO2 gas reactant. According to the number of reacted molecules on the surface, Printex U soot presents more reducing sites than diesel and GTL soot. Initial uptake coefficients for GTL and diesel soot for the reaction with CF3COOH gas reactant are very similar and no clear conclusions can be obtained related to the initial reactivity. The number of reacted molecules calculated for CF3COOH reactions shows values two orders of magnitude higher than the corresponding to NO2 reactions, indicating a greater presence of basic functionalities in the soot surfaces. More information of the surface composition has been obtained using Diffuse Reflectance Infrared Fourier Transform Spectroscopy (DRIFTS) before and after the reaction of soot samples with gas reactants. As conclusion, the interface of diesel and GTL soot before reaction mainly consists of polycyclic aromatic hydrocarbons (PAHs), nitro-compounds as well as ether functionalities. After reaction with gas reactant, it was observed that PAHs and nitro-compounds remain on the soot surface and new spectral bands such as carbonyl groups (carboxylic acids, aldehydes, esters and ketones) are observed. Physical properties of soot from both fuels studied such as BET surface isotherm and SEM analysis were also developed and related to the observed reactivity.

Investigation of Chemical Kinetics on Soot Formation Event of n-Heptane Spray Combustion

DEFF Research Database (Denmark)

Pang, Kar Mun; Jangi, Mehdi; Bai, Xue-Song

2014-01-01

. Numerical computation is performed using OpenFOAM and chemistry coordinate mapping (CCM) approach is used to expedite the calculation. Three n-heptane kinetic mechanisms with different chemistry sizes and comprehensiveness in oxidation pathways and soot precursor formation are adopted. The three examined...

Penetration in bimodal, polydisperse granular material

KAUST Repository

Kouraytem, Nadia; Thoroddsen, Sigurdur T; Marston, J. O.

2016-01-01

We investigate the impact penetration of spheres into granular media which are compositions of two discrete size ranges, thus creating a polydisperse bimodal material. We examine the penetration depth as a function of the composition (volume fractions of the respective sizes) and impact speed. Penetration depths were found to vary between delta = 0.5D(0) and delta = 7D(0), which, for mono-modal media only, could be correlated in terms of the total drop height, H = h + delta, as in previous studies, by incorporating correction factors for the packing fraction. Bimodal data can only be collapsed by deriving a critical packing fraction for each mass fraction. The data for the mixed grains exhibit a surprising lubricating effect, which was most significant when the finest grains [d(s) similar to O(30) mu m] were added to the larger particles [d(l) similar to O(200 - 500) mu m], with a size ratio, epsilon = d(l)/d(s), larger than 3 and mass fractions over 25%, despite the increased packing fraction. We postulate that the small grains get between the large grains and reduce their intergrain friction, only when their mass fraction is sufficiently large to prevent them from simply rattling in the voids between the large particles. This is supported by our experimental observations of the largest lubrication effect produced by adding small glass beads to a bed of large sand particles with rough surfaces.

Penetration in bimodal, polydisperse granular material

KAUST Repository

Kouraytem, N.

2016-11-07

We investigate the impact penetration of spheres into granular media which are compositions of two discrete size ranges, thus creating a polydisperse bimodal material. We examine the penetration depth as a function of the composition (volume fractions of the respective sizes) and impact speed. Penetration depths were found to vary between delta = 0.5D(0) and delta = 7D(0), which, for mono-modal media only, could be correlated in terms of the total drop height, H = h + delta, as in previous studies, by incorporating correction factors for the packing fraction. Bimodal data can only be collapsed by deriving a critical packing fraction for each mass fraction. The data for the mixed grains exhibit a surprising lubricating effect, which was most significant when the finest grains [d(s) similar to O(30) mu m] were added to the larger particles [d(l) similar to O(200 - 500) mu m], with a size ratio, epsilon = d(l)/d(s), larger than 3 and mass fractions over 25%, despite the increased packing fraction. We postulate that the small grains get between the large grains and reduce their intergrain friction, only when their mass fraction is sufficiently large to prevent them from simply rattling in the voids between the large particles. This is supported by our experimental observations of the largest lubrication effect produced by adding small glass beads to a bed of large sand particles with rough surfaces.

Simultaneous planar measurements of soot structure and velocity fields in a turbulent lifted jet flame at 3 kHz

Science.gov (United States)

Köhler, M.; Boxx, I.; Geigle, K. P.; Meier, W.

2011-05-01

We describe a newly developed combustion diagnostic for the simultaneous planar imaging of soot structure and velocity fields in a highly sooting, lifted turbulent jet flame at 3000 frames per second, or two orders of magnitude faster than "conventional" laser imaging systems. This diagnostic uses short pulse duration (8 ns), frequency-doubled, diode-pumped solid state (DPSS) lasers to excite laser-induced incandescence (LII) at 3 kHz, which is then imaged onto a high framerate CMOS camera. A second (dual-cavity) DPSS laser and CMOS camera form the basis of a particle image velocity (PIV) system used to acquire 2-component velocity field in the flame. The LII response curve (measured in a laminar propane diffusion flame) is presented and the combined diagnostics then applied in a heavily sooting lifted turbulent jet flame. The potential challenges and rewards of application of this combined imaging technique at high speeds are discussed.

Comparison of the Raman spectra of ion irradiated soot and collected extraterrestrial carbon

Science.gov (United States)

Brunetto, R.; Pino, T.; Dartois, E.; Cao, A.-T.; d'Hendecourt, L.; Strazzulla, G.; Bréchignac, Ph.

2009-03-01

We use a low pressure flame to produce soot by-products as possible analogues of the carbonaceous dust present in diverse astrophysical environments, such as circumstellar shells, diffuse interstellar medium, planetary disks, as well as in our own Solar System. Several soot samples, displaying an initial chemical diversity from aromatic to aliphatic dominated material, are irradiated with 200-400 keV H +, He +, and Ar ++ ions, with fluences comprised between 10 14 and 10 16 ions/cm 2, to simulate expected radiation induced modification on extraterrestrial carbon. The evolution of the samples is monitored using Raman spectroscopy, before, during, and after irradiation. A detailed analysis of the first- and second-order Raman spectra is performed, using a fitting combination of Lorentzian and/or Gaussian-shaped bands. Upon irradiation, the samples evolve toward an amorphous carbon phase. The results suggest that the observed variations are more related to vacancy formation than ionization processes. A comparison with Raman spectra of extraterrestrial organic matter and other irradiation experiments of astrophysically relevant carbonaceous materials is presented. The results are consistent with previous experiments showing mostly amorphization of various carbonaceous materials. Irradiated soots have Raman spectra similar to those of some meteorites, IDPs, and Comet Wild 2 grains collected by the Stardust mission. Since the early-Sun expected irradiation fluxes sufficient for amorphization are compatible with accretion timescales, our results support the idea that insoluble organic matter (IOM) observed in primitive meteorites has experienced irradiation-induced amorphization prior to the accretion of the parent bodies, emphasizing the important role played by early solar nebula processing.

The Ångström Exponent and Turbidity of Soot Component in the ...

African Journals Online (AJOL)

Corresponding author: ... Origin 50 software was used to plot the graphs. SPSS 16.0 ... The α reflects the dominance of fine-mode particles while α2 at 0% RH reflects the dominance of ... 99% of the mass is carbon, but soot also contains hydrocarbons ...

Density separation of combustion-derived soot and petrogenic graphitic black carbon: Quantification and isotopic characterization

International Nuclear Information System (INIS)

Veilleux, M-H; Gelinas, Y; Dickens, A F; Brandes, J

2009-01-01

The black carbon continuum is composed of a series of carbon-rich components derived from combustion or metamorphism and characterized by contrasting environmental behavior and susceptibility to oxidation. In this work, we present a micro-scale density fractionation method that allows isolating the small quantities of soot-like and graphitic material usually found in natural samples. Organic carbon and δ 13 C mass balance calculations were used to quantify the relative contributions of the two fractions to thermally-stable organic matter from a series of aquatic sediments. Varying proportions of soot-like and graphitic material were found in these samples, with large variations in δ 13 C signatures suggesting important differences in their origin and/or dynamics in the environment.

SO2 influence on the K/La2O3 soot combustion catalyst deactivation

International Nuclear Information System (INIS)

Peralta, M.A.; Ulla, M.A.; Querini, C.A.

2008-01-01

In the present work, K/La 2 O 3 was prepared and tested as a potential catalyst to be used in a diesel engine exhaust. The soot combustion activity was evaluated by temperature-programmed-oxidation (TPO), and the NO x -catalyst interaction was studied using a microbalance experiment. The SO 2 poisoning process and the regeneration of a poisoned K/La 2 O 3 catalyst were analyzed. The fresh catalyst presented a good soot combustion activity. After being treated with a 1000 ppm SO 2 stream, the catalyst was poisoned due to lanthanum sulfate and potassium sulfate formation. The NO x treatment contributed to the K 2 (SO 4 ) decomposition at the expense of extra La 2 (SO 4 ) 3 formation and the H 2 treatment contributed to the La 2 (SO 4 ) 3 decomposition. (author)

Soot Formation and Destruction in High-Pressure Flames with Real Fuels

Science.gov (United States)

2013-08-18

Temperature and Oxygen Concentration on Diesel Spray Combustion Using a Single- Nozzle Injector in a Constant Volume Combustion Chamber, Combustion...enable the design of more efficient diesel engines. Higher efficiency will help reduce the logistical demand transportation fuels place on the entire...understanding of the soot formation processes at elevated pressure (e.g., 30 atm) will enable the design of more efficient diesel engines. Higher

Damköhler number effects on soot formation and growth in turbulent nonpremixed flames

KAUST Repository

Attili, Antonio; Bisetti, Fabrizio; Mueller, Michael E.; Pitsch, Heinz

2015-01-01

numbers. A reduced chemical mechanism, which includes the soot precursor naphthalene, and a high-order method of moments are employed. At the highest Damköhler number, local extinction is negligible, while flames holes are observed in the two lowest

Morphological investigation of polydisperse asymmetric block copolymer systems of poly(styrene) and poly(methacrylic acid) in the strong segregation regime

DEFF Research Database (Denmark)

Asad Ayoubi, Mehran; Zhu, Kaizheng; Nyström, Bo

2013-01-01

Samples of compositionally (highly) asymmetric diblock copolymers and, also, mixtures of diblock and triblock copolymers (the latter obtained as end-coupling products of two diblock molecules of the mixture), composed of (a) monodisperse majority block(s) of poly(styrene) (PS) and a polydisperse...

An experimental study on the effects of different opening ranges of waste-gate on the exhaust soot emission of a turbo-charged DI diesel engine

International Nuclear Information System (INIS)

Ghazikhani, M.; Davarpanah, M.; Shaegh, S.A. Mousavi

2008-01-01

This experimental study was conducted to investigate the effects of different opening ranges of waste-gate of a turbo-charged DI diesel engine on improving the exhaust soot emission. Different opening ranges of waste-gate were supplied using an adjustable spring to load the actuating rod of the waste-gate in which, increasing the opening range of the waste-gate decreases the inlet manifold pressure. In this study, the maximum inlet manifold pressures which were supplied by changing the opening range of waste-gate were 0.1 bar, 0.23 bar, 0.26 bar and 0.52 bar over atmosphere and experiments were conducted under the ECE-R49, 13 mode standard test. At each mode of the test, soot emission was recorded and then brake specific soot emission was calculated. Results indicate that, soot emission decreases with increasing the maximum inlet manifold pressure from 0.1 bar to 0.23 bar. This reduction may be due to increasing the intake-air temperature which results in reduction of ignition delay that prolongs the late combustion phase. This improves the soot burnout process because enough time and sufficient in-cylinder temperature are available at the late combustion phase prior to exhaust valve opening. While for the higher maximum inlet manifold pressures from 0.23 bar to 0.52 bar, although there are enough time at the late combustion phase, but the soot emission increases which could be due to more reduction of the in-cylinder gas temperature at the end of combustion before EVO

Gadolinium doped cerium oxide for soot oxidation: Influence of interfacial metal–support interactions

International Nuclear Information System (INIS)

Durgasri, D. Naga; Vinodkumar, T.; Lin, Fangjian; Alxneit, Ivo; Reddy, Benjaram M.

2014-01-01

Graphical abstract: - Highlights: • Supported Ce-Gd-oxides are applied for soot oxidation for the first time. • Gd 2 O 3 doping facilitates enhanced extrinsic oxygen vacancy concentration in ceria. • The Ce-Gd/TiO 2 exhibited the highest soot oxidation activity. • Key parameters that involved in tuning the activity are discussed. - Abstract: The aim of the present investigation was to ascertain the role of Al 2 O 3 , SiO 2 , and TiO 2 supports in modulating the catalytic performance of ceria-based solid solutions. In this study, we prepared nanosized Ce-Gd/Al 2 O 3 , Ce-Gd/SiO 2 , and Ce-Gd/TiO 2 catalysts by a deposition coprecipitation method and evaluated for soot oxidation. The synthesized catalysts were calcined at two different temperatures to assess their thermal stability and extensively characterized by various techniques, namely, XRD, Raman, BET surface area, TEM, H 2 -TPR, and UV–vis DRS. XRD and TEM results indicate that Ce-Gd-oxide nanoparticles are in highly dispersed form on the surface of the supports. Raman results show a prominent sharp peak and a broad peak corresponding to the F 2g mode of ceria and the presence of oxygen vacancies, respectively. The presence of a significant number of oxygen vacancies in all samples is also confirmed from UV–vis DRS measurements. The H 2 -TPR results suggest that Gd-doping facilitates the reduction of the materials and decreases the onset temperature of reduction. Among the prepared samples, Ce-Gd/TiO 2 catalyst exhibited the highest activity, suggesting the existence of strong interfacial metal support interaction between the active metal oxide and the support

Kinetic study of diesel soot oxidation: application to simulation of diesel particulate filter regeneration; Etude cinetique de la combustion des suies diesel: application a la modelisation de la regeneration du filtre a particule

Energy Technology Data Exchange (ETDEWEB)

Huguet, Ch.

2005-11-15

Because of their toxicity, soot are considered as the most important pollutant from Diesel engines. The Diesel Particulate Filter (DPF) is widely deployed in Europe to address the significant reductions in particulate emissions required by increasingly stringent emission standards, both for heavy duty vehicles and passenger cars. Such a DPF filtrates above 99% of soot emissions and must be regularly regenerated. The use of additive allows to decrease the soot oxidation temperature to values which can be reached by appropriate engine tuning. The soot addition is a dominant parameter for the development of regeneration strategies. Its influence must be correctly represented by models. This Ph-D was performed at IFP in collaboration with ADEME and was supported by the LCSR at Orleans. The aim of the present research is to develop a kinetic mechanism characteristic of Diesel soot oxidation, which can be integrated into a DPF regeneration model and used for engine control. The oxidation study was based on soot characterisation and reaction kinetics investigations. The samples of Diesel soot were collected, without and with Cerium/Iron additive, by using two engines points representative of two normalized European cycles (ECE and EUDC). Thermal and composition analyses with techniques such as XPS, XRD or TEM were used to determine their physical and chemical properties. Their oxidation kinetics was experimentally studied on a synthetic gas bench (SGB) with a fixed bed reactor. Different tests were performed: temperature-programmed oxidation (TPO), Isothermal oxidation (IO), and sequential oxidation. The results allowed to correlate Diesel soot physical and chemical properties with their oxidation rate. A kinetic model was developed, which is based on global carbon consummation law and distinguishes the oxidation of different soot components. The simulation results agree very well with the experimental results of Diesel soot oxidation. (author)

Reflectance spectroscopy is an effective tool for monitoring soot pollution in an urban suburb.

Science.gov (United States)

Saaroni, H; Chudnovsky, A; Ben-Dor, E

2010-02-01

This study examines whether converting the fossil fuel of the Tel Aviv power station from oil to gas influences air pollution in the local urban environment. To this end, the spectral properties of accumulated dust on tree leaves and paper bags were assessed before (2004) and after (2006) the conversion. The sampling site was a garden in a neighborhood located 2700m downwind of the power station. In addition, air pollution concentrations and particulate matter parameters recorded by a local meteorological station were analyzed (PM(10), NO(x), NO(2), NO, and SO(2)). Although differences in the average monthly concentration of pollution parameters are mostly insignificant between the two periods, the accumulated particulate matter exhibits considerably different spectral patterns. All first period samples exhibit a distinctly concave slope in the spectral region between 400 and 1400nm, indicative of high amounts of soot, most likely due to the combustion products of fuel oil exhausted by the power plant. In contrast, the second period samples exhibit spectra that indicate reduced soot content and even appear slightly convex, evidencing the presence of dust of mineral origin, a feature likely masked by the soot in the first period. Thus, the spectral data support that the power plant conversion results in less pollution. More generally, this study corroborates that VIS-NIR-SWIR spectroscopy characterizes key properties of the particulate layer accumulating on sampled surfaces and thus, is a powerful method for monitoring the urban environment. Copyright 2009 Elsevier B.V. All rights reserved.

Influence of asphaltene aggregation and pressure on crude oil emulsion stability

Energy Technology Data Exchange (ETDEWEB)

Auflem, Inge Harald

2002-07-01

Water-in-crude oil emulsions stabilised by various surface-active components are one of the major problems in relation to petroleum production. This thesis presents results from high-pressure separation experiments on ''live'' crude oil and model oil emulsions, as well as studies of Interactions between various indigenous stabilising materials in crude oil. A high-pressure separation rig was used to study the influence of gas and gas bubbles on the separation of water-in-crude oil emulsions. The results were interpreted as a flotation effect from rising gas bubbles, which led to increased separation efficiency. The separation properties of a ''live'' crude oil were compared to crude oil samples recombined with various gases. The results showed that water-in-oil emulsions produced from the ''live'' crude oil samples, generally separated faster and more complete, than emulsions based on recombined samples of the same crude oil. Adsorption of asphaltenes and resins onto a hydrophilic surface from solutions with varying aromatic/aliphatic character was investigated by a quarts crystal microbalance. The results showed that asphaltenes adsorbed to a larger degree than the resins. The resins were unable to desorb pre-adsorbed asphaltenes from the surface, and neither did they adsorb onto the asphaltene-coated surface. In solutions of both of resins and asphaltenes the two constituents associated in bulk liquid and adsorbed to the surface in the form of mixed aggregates. Near infrared spectroscopy and pulsed field gradient spin echo nuclear magnetic resonance were used to study asphaltene aggregation and the influence of various amphiphiles on the asphaltene aggregate size. The results showed Interactions between the asphaltenes and various chemicals, which were proposed to be due to acid-base interactions. Among the chemicals used were various naphthenic acids. Synthesised monodisperse acids gave a reduction of size of the asphaltene aggregates, whereas polydisperse

Influence of asphaltene aggregation and pressure on crude oil emulsion stability

Energy Technology Data Exchange (ETDEWEB)

Auflem, Inge Harald

2002-07-01

size of the asphaltene aggregates, whereas polydisperse naphthenic acids seemed to affect the state of the asphaltenes only to a minor extent. The effect of the naphthenic acids on the asphaltenes appeared however, to depend on the asphaltene type. Other amphiphiles such as amines and alcohols, showed a varying effect on the dispersion of the asphaltenes into smaller aggregates. Furthermore, measurements of diffusion coefficients upon increased concentration of asphaltenes, implied that the asphaltenes began to self-associate at concentrations above 0.1 wt-% in toluene-d{sub 8}. (author)

Polydisperse-particle-size-distribution function determined from intensity profile of angularly scattered light

International Nuclear Information System (INIS)

Alger, T.W.

1979-01-01

A new method for determining the particle-size-distribution function of a polydispersion of spherical particles is presented. The inversion technique for the particle-size-distribution function is based upon matching the measured intensity profile of angularly scattered light with a summation of the intensity contributions of a series of appropriately spaced, narrowband, size-distribution functions. A numerical optimization technique is used to determine the strengths of the individual bands that yield the best agreement with the measured scattered-light-intensity profile. Because Mie theory is used, the method is applicable to spherical particles of all sizes. Several numerical examples demonstrate the application of this inversion method

Development of high fidelity soot aerosol dynamics models using method of moments with interpolative closure

KAUST Repository

Roy, Subrata P.; Arias, Paul G.; Lecoustre, Vivien R.; Haworth, Daniel C.; Im, Hong G.; Trouvé , Arnaud C.

2014-01-01

of ad hoc treatments such as clipping. The solutions proposed and demonstrated here are being applied to generate new physical insight into complex turbulence-chemistry-soot-radiation interactions in turbulent reacting flows using DNS. © 2014 Copyright

A smoothed particle hydrodynamics (SPH) study on polydisperse sediment from technical activities on seabed

Science.gov (United States)

Tran-Duc, Thien; Phan-Thien, Nhan; Khoo, Boo Cheong