Combustion modeling in large scale volumes using EUROPLEXUS code

Most of the numerical benchmarks on combustion in large scale volumes for hydrogen safety, which were performed up until today have demonstrated, that current numerical codes and physical models experience poor predictive capabilities at the industrial scale, both due to under-resolution and deficiencies in combustion modeling. This paper describes a validation of the EUROPLEXUS code against several large scale experimental data sets in order to improve its hydrogen combustion modeling capabilities in industrial settings (e.g. reactor buildings). The code is based on the Euler equations and employs an algorithm for the propagation of reactive interfaces, RDEM, which includes a combustion wave, as an integrable part of the Reactive Riemann problem, propagating with a fundamental flame speed (being a function of initial mixture properties as well as gas dynamics parameters). Validation of the first combustion model implemented in the code is based on obstacle-laden channels, interconnected reactor-type compartments, vented enclosures and covers all major premixed flame combustion regimes (slow, fast and detonation) with an aim to obtain conservative results. An improvement of this model is found in a direction of transient interaction of flame fronts with regions of elevated integral length scales presented in the velocity gradient field due to e.g. interactions with geometrical non-uniformities and pressure waves.     

Effects of bed material size distribution, operating conditions and agglomeration phenomenon on heavy metal emission in fluidized bed combustion process

This study investigates the effects of the bed material size distribution, the operating conditions and the agglomeration/defluidization phenomenon on the heavy metal pollutant emissions in the combustion process. After defluidization, the emission concentration of heavy metals increased, because Na may form a low melting eutectic material that enhances bed material adherence. The emission of Cd increased when the feed simulated urban residues contained sodium; however, the presence of Na had no significant effect on the emission of Cr. Furthermore, the Cd emission concentration was low when the material had a Gaussian distribution; however, the decreases in the Cd emission when the bed material had narrow, binary or flat distributions were not significant. The heavy metal Cr showed the same trend. In addition to the operating parameters, the bed material size distribution may influence the heavy metal emissions during combustion processes.     

Using Radiocarbon to Apportion Sources of Polycyclic Aromatic Hydrocarbons in Household Soot

To determine whether polycyclic aromatic hydrocarbons (PAHs) in household soot were derived from the combustion of scrap wood or creosote that was impregnated in the wood (or some combination of both), the molecular composition and radiocarbon ( 14 C) content of the total carbon and several PAHs in the soot was investigated. The 5730-year half-life of 14 C makes it an ideal marker for identifying creosote-derived PAHs ( 14 C-free) versus those derived from the combustion of wood (contemporary 14 C). The 14 C abundance of phenanthrene, fluoranthene, pyrene, and retene was determined by accelerator mass spectrometry after solvent extraction and purification by preparative capillary gas chromatography. The molecular analysis (presence of retene and 1,7-dimethylphenanthrene) and bulk 14 C content (contemporary) of the soot indicated that wood combustion was a strong source of carbon to the soot. The 14 C of retene in two soot samples was also contemporary, indicating that it was derived from the combustion of the scrap wood. These results are consistent with previous work that has suggested that retene is an excellent marker of wood combustion. However, the 14 C content of phenanthrene, fluoranthene, and pyrene in one soot sample was much lower and revealed that these compounds had a mixed creosote and wood source. Using an isotopic mass balance approach, we estimate that 40 to 70% of phenanthrene, fluoranthene, and pyrene were derived from the combustion of the scrap wood. The results of this study show that molecular marker and bulk 14 C analysis can be potentially misleading in apportioning sources of every PAH, and that molecular-level 14 C analysis of PAHs can be a powerful tool for environmental forensics.     

An influence of oxygen content in an oxidizing atmosphere on inhibitive action of fluorinated agents on a hydrogen flame

An experimental investigation of the influence of inhibitors of various chemical natures on flammability limits in mixtures H₂+oxidizer (O₂+N₂)–suppressant (C₂HF₅; CHF₃; C₄F₁₀; inhibitor AKM, which is a mixture of olefins) was carried out. Compositions of N₂ and O₂ with elevated (25 vol%) and reduced (15 vol%) oxygen concentrations and air were used as oxidizing atmospheres. Experiments were done at room temperature and atmospheric pressure. Flammability limits were determined in a closed vessel of volume of 4.2 dm³ (internal diameter 20 cm). Mixtures were prepared immediately in the preliminary evacuated reaction vessel by partial pressures. The mixtures were ignited by an electrical spark of energy near 1 J in the center of the reaction vessel. A flame propagation was detected by a pressure transducer. Twelve flammability curves were measured, which allowed to compare effectiveness of the inhibitors at various oxygen contents in the atmosphere. A qualitative analysis of the obtained results was done, which showed an important role of an inhibitor regeneration.     

Parametric study of the explosivity of graphite-metals mixtures

The explosivity of dust clouds is greatly influenced by several parameters which depend on the operating conditions, such as the initial turbulence, temperature or ignition energy, but obviously also on the materials composition. In the peculiar case of a mixture of two combustible powders, the physical and chemical properties of both dusts have an impact on the cloud flammability and on its explosivity. Nevertheless, no satisfactory ‘mixing laws’ predicting the mixture behavior are currently available and the composition variable to be considered for such models greatly depend on the safety parameters which have to be determined: from volume ratios for some thermal exchanges and ignition phenomena, to surface proportions for some heterogeneous reactions and molar contents for chemical reactions. This study is mainly focused on graphite/magnesium mixtures as they are encountered during the decommissioning activities of UNGG reactors (Natural Uranium Graphite Gas). Due to the different nature and reactivity of both powders, these mixtures offer a wide range of interests. Firstly, the rate-limiting steps for the combustion of graphite are distinct from those of metals (oxygen diffusion or metal vaporization). Secondly, the flame can be thickened by the presence of radiation during metal combustion, whereas this phenomenon is negligible for pure graphite. Finally, the turbulence of the initial dust cloud is modified by the addition of a second powder. In order to assess the explosivity of graphite/magnesium clouds, a parametric study of the effects of storage humidity, particle size distribution, ignition energy, and initial turbulence has been carried out. In particular, it was clearly demonstrated that the turbulence significantly influences the explosion severity by speeding up the rate of heat release on the one hand and the oxygen diffusion through the boundary layer surrounding particles on the other hand. Moreover, it modifies the mean particle size and the spatial dust distribution in the test vessel, impacting the uniformity of the dust cloud. Thus, the present work demonstrates that the procedures developed for standard tests are not sufficient to assess the dust explosivity in industrial conditions and that an extensive parametric study is relevant to figure out the explosive behavior of solid/solid mixtures subjected to variations of operating conditions.     

燃煤高温固硫的机理及固硫影响因素探讨

燃烧中固硫是一种适合我国国情的燃煤脱硫技术。本文探讨了燃煤高温固硫过程的主要反应机理和一些常用固硫添加剂的助固硫作用,分析了影响固硫效率的主要因素,进而提出实际应用中应考虑的提高固硫效率的措施。     

Miscanthus × Giganteus straw and pellets as sustainable fuels

In this paper we present, for the first time, data on the combustion of Miscanthus × Giganteus straw and pellets. We found that the heating value of Miscanthus is 17.744 MJ/kg. The gaseous emission indices of SO₂, NO _x and total organic carbon (TOC) in the exhaust are reported and compared with the European standards for biomass boilers. On the basis of our results, it is possible to evaluate a net energy yield between 152 and 326 MJ/hectare/year for the cultivation of Miscanthus with an energy balance estimated to be in the range of 7.7–15.4. According to the presented results, it seems reasonable to consider Miscanthus as a promising candidate as alternative fuel.     

Detection of combustion formed nanoparticles

UV–visible extinction and scattering and two extra situ sampling techniques: atomic force microscopy (AFM) and differential mobility analysis (DMA) are used to follow the evolution of the particles formed in flames. These particle sizing techniques were chosen because of their sensitivity to detect inception particles, which have diameters, d<5 nm, too small to be observed with typical particle measurement instrumentation. The size of the particles determined by AFM and DMA compares well with the size determined by in situ optical measurements, indicating that the interpretation of the UV–visible optical signal is quite good, and strongly showing the presence of d=2–4 nm particles. UV–visible extinction measurements are also used to determine the concentration of d=2–4 nm particles at the exhausts of practical combustion systems. A numerical model, able to reproduce the experimentally observed low coagulation rate of nanoparticles with respect to soot particles, is used to investigate the operating conditions in the combustion chamber and exhaust system for which 2–4 nm particles survive the exhaust or grow to larger sizes. Combustion generated nanoparticles are suspected to affect human and environmental health because of their affinity for water, small size, low rate of coagulation, and large surface area/weight ratio. The ability to isolate nanoparticles from soot particles in hydrosols collected from combustion may be useful for future analysis by a variety of techniques and toxicological assays.     

Source apportionment and source/sink relationships of PAHs in the coastal atmosphere of Chicago and Lake Michigan

Multivariate statistical techniques were used to investigate source apportionment and source/sink relationships for polycyclic aromatic hydrocarbons (PAHs) in the urban and adjacent coastal atmosphere of Chicago/Lake Michigan in 1994–1995. The PAH signatures for the atmospheric particle phase, surface water particle phase and sediments indicate that atmospheric deposition is the major source of PAHs to the sediments and water column particulate phase of Lake Michigan. The PAH signature for the atmospheric gas phase and water dissolved phase indicate an intimate linkage between the lake and its overlying atmosphere. A modified factor analysis-multiple regression model was successfully applied to the source apportionment of atmospheric PAHs (gas+particle). Coal combustion accounted for 48±5% of the ΣPAH concentration in both the urban and adjacent coastal atmosphere, natural gas combustion accounted for 26±2%, coke ovens accounted for 14±3%, and vehicle emissions (gas+diesel) accounted for 9±4%. Each is an identified source category for the region. These results are consistent with the mix of fossil fuel combustion sources and ratios of indicator PAHs.