An experimental and detailed chemical kinetic modeling study of hydrogen and syngas mixture oxidation at elevated pressures

Knocking combustion in spark-ignition engines

A detailed chemical kinetic model has been used to study dimethyl ether (DME) oxidation over a wide range of conditions. Experimental results obtained in a jet-stirred reactor (JSR) at I and 10 atm, 0.2 < 0 < 2.5, and 800 < T < 1300 K were modeled, in addition to those generated in a shock tube at 13 and 40 bar, 0 = 1.0 and 650 :5 T :5 1300 K. The JSR results are particularly valuable as they include concentration profiles of reactants, intermediates and products pertinent to the oxidation of DME. These data test the Idnetic model severely, as it must be able to predict the correct distribution and concentrations of intermediate and final products formed in the oxidation process. Additionally, the shock tube results are very useful, as they were taken at low temperatures and at high pressures, and thus undergo negative temperature dependence (NTC) behavior. This behavior is characteristic of the oxidation of saturated hydrocarbon fuels, (e.g. the primary reference fuels, n-heptane and iso- octane) under similar conditions. The numerical model consists of 78 chemical species and 336 chemical reactions. The thermodynamic properties of unknown species pertaining to DME oxidation were calculated using THERM.

/pdf/wide-range-modeling-study-of-dimethyl-ether-oxidation-pnag57ojwu.pdf

Wide range modeling study of dimethyl ether oxidation

Internal combustion engines running on liquid fuels will remain the dominant prime movers for road and air transportation for decades, probably for most of this century. The world’s appetite for liquid transportation fuels derived from petroleum and other fossil resources is already immense, will grow, will at some future time become economically unsustainable, and will become infeasible only in the very long term. The ongoing process of augmenting and eventually replacing petroleum-derived fuels with liquid alternative fuels must necessarily involve approaches that result in comparatively much lower net carbon cycle emissions from the transportation sector, most likely through a combination of carbon sequestration and renewable fuel production. The successful growth and establishment of a sustainable, profitable alternative fuels industry will be best facilitated by approaches that integrate alternative products into petroleum-derived fuel streams (i.e., gasolines, diesel, and jet fuels) and consider synergistic evolution of and integration with prevailing refining and liquid fuel distribution infrastructures. The emergence of low temperature combustion strategies, particularly those implementing dual fuel methods to achieve Reaction Controlled Compression Ignition (RCCI), offers the potential to significantly improve operating efficiency and reduce emissions with minimal aftertreatment. For all advanced combustion engine technologies, but especially for RCCI, a clear understanding of fuel property influences on combustion behaviors will be important to achieving projected engine performance and emissions. To achieve the benefits projected by emerging engine technologies, the properties of petroleum-derived fuels themselves must be modified over time, but the effects of blending candidate alternative fuels with these conventional fuels must also be understood. Predicting the coupled physical and chemical property effects of real fuels on energy conversion system performance and emissions is a daunting problem, even for petroleum-derived real fuels, since each is composed of several hundred to thousands of individual chemical species typically belonging to one of a few organic classes (e.g., n-paraffins, iso-paraffins, cyclo-paraffins, olefins, aromatics). For specific combustion applications, it is often the global combustion response to variations in the composition of fuel mixtures – inclusive of those occurring by blending petroleum-derived fuel with alternative fuel candidates – that is of interest for fuel property optimization. This paper presents an overview of tools used for evaluating and emulating combustion-relevant properties of real fuels and alternative fuel candidates. New analytical and statistical methods can provide important insights as to how the ensembles of distinct molecular structures found in a given fuel mixture contribute to the physical and chemical kinetic properties that govern its combustion in energy conversion processes. Such tools can in turn assist in screening candidate alternative fuels for more detailed study.

/pdf/chemical-kinetic-and-combustion-characteristics-of-3f77lp0ycz.pdf

Chemical kinetic and combustion characteristics of transportation fuels

The purpose of this paper is to provide a source of information on thermal energy use in buildings, its drivers, and their past, present and future trends on a global and regional basis. Energy use in buildings forms a large part of global and regional energy demand. The importance of heating and cooling in total building energy use is very diverse with this share varying between 18% and 73%. Biomass is still far the dominant fuel when a global picture is considered; the role of electricity is substantially growing, and the direct use of coal is disappearing from this sector, largely replaced by electricity and natural gas in the most developed regions. This paper identifies the different drivers of heating and cooling energy demand, and decomposes this energy demand into key drivers based on a Kaya identity approach: number of households, persons per household, floor space per capita and specific energy consumption for residential heating and cooling; and GDP, floor space per GDP, and specific energy consumption for commercial buildings. This paper also reviews the trends in the development of these drivers for the present, future – and for which data were available, for the past – in 11 world regions as well as globally. Results show that in a business-as-usual scenario, total residential heating and cooling energy use is expected to more or less stagnate, or slightly decrease, in the developed parts of the world. In contrast, commercial heating and cooling energy use will grow in each world region. Finally, the results show that per capita total final residential building energy use has been stagnating in the vast majority of world regions for the past three decades, despite the very significant increases in energy service levels in each of these regions.

Heating and cooling energy trends and drivers in buildings

Basic engine thermodynamics predicts that spark ignited engine efficiency is a function of both the compression ratio of the engine and the specific heat ratio of the working fluid. In practice the compression ratio of the engine is often limited due to knock. Both higher specific heat ratio and higher compression ratio lead to higher end gas temperatures and increase the likelihood of knock. When the knock limit is not reached, increased heat transfer losses at higher compression ratios can limit efficiency. In this paper, we investigate the role of both the compression ratio and the specific heat ratio on engine efficiency by conducting experiments comparing operation of a single-cylinder variable-compression ratio engine with both hydrogen–air and hydrogen–oxygen–argon mixtures. For low load operation, it is found that the hydrogen–oxygen–argon mixtures result in higher indicated thermal efficiencies. Peak efficiency for the hydrogen–oxygen–argon mixtures is found at compression ratio 5.5, whereas for the hydrogen–air mixture with an equivalence ratio of 0.24 the peak efficiency is found at compression ratio 13. The spark timing when operating the engine with hydrogen–oxygen–argon was found to be knock limited for compression ratios above 4.5. However, for operation with hydrogen–air the spark timing was not limited by knock. We apply a three-zone model to help explain the effects of specific heat ratio and compression ratio on efficiency. Operation with hydrogen–oxygen–argon mixtures at low loads is more efficient because the lower compression ratio results in a substantially larger portion of the gas residing in the adiabatic core rather than in the boundary layer and crevices, leading to less heat transfer and more complete combustion.

/pdf/increased-efficiency-in-si-engine-with-air-replaced-by-1youetrexx.pdf

Increased efficiency in SI engine with air replaced by oxygen in argon mixture

Extending the Lean Stability Limits of Gasoline Using a Microwave-Assisted Spark Plug

Investigation of biofuels from microorganism metabolism for use as anti-knock additives

In order to address the health risks and climate impacts associated with pollution from cooking on biomass fires, researchers have focused on designing new cookstoves that improve cooking performance and reduce harmful emissions, specifically particulate matter (PM). One method for improving cooking performance and reducing emissions is using air injection to increase turbulence of unburned gases in the combustion zone. Although air injection reduces total PM mass emissions, the effect on PM size distribution and number concentration has not been thoroughly investigated. Using two new wood-burning cookstove designs from Lawrence Berkeley National Laboratory, this research explores the effect of air injection on cooking performance, PM and gaseous emissions, and PM size distribution and number concentration. Both cookstoves were created using the Berkeley-Darfur Stove as the base platform to isolate the effects of air injection. The thermal performance, gaseous emissions, PM mass emissions, and particle concentrations (ranging from 5 nm to 10 μm in diameter) of the cookstoves were measured during multiple high-power cooking tests. The results indicate that air injection improves cookstove performance and reduces total PM mass but increases total ultrafine (less than 100 nm in diameter) PM concentration over the course of high-power cooking.

/pdf/reducing-ultrafine-particle-emissions-using-air-injection-in-30ml3o2699.pdf

Reducing Ultrafine Particle Emissions Using Air Injection in Wood-Burning Cookstoves.

The purpose of this research is to investigate the impact of fuel composition on auto-ignition in homogeneous charge compression ignition (HCCI) engines in order to develop a future metric for predicting fuel performance in future HCCI engine technology. A single-cylinder, variable compression ratio engine operating as an HCCI engine was used to test reference fuels and gasoline blends with octane numbers (ON) ranging from 60 to 88. Correlations between fuel composition, ON, and two existing methods for predicting fuel auto-ignition in HCCI engines (Kalghatgi's octane index and Shibata and Urushihara's HCCI index) are investigated. Results show that octane index and HCCI index poorly predict the impact of fuel composition on auto-ignition for fuels with the same ON. The effect of ethanol in delaying auto-ignition depends on the composition of the original gasoline blend; the same is true for the addition of naphthenes. Low-temperature heat release (LTHR) correlates well with auto-ignition for gasoline fue...

Vi H. Rapp

Papers

Increased efficiency in SI engine with air replaced by oxygen in argon mixture

Extending the Lean Stability Limits of Gasoline Using a Microwave-Assisted Spark Plug

Investigation of biofuels from microorganism metabolism for use as anti-knock additives

Reducing Ultrafine Particle Emissions Using Air Injection in Wood-Burning Cookstoves.

Predicting Fuel Performance for Future HCCI Engines