scholarly journals A Skeletal Kinetic Model For Biodiesel Fuels Surrogate Blend Under Diesel-Engine Conditions

2015 ◽  
Vol 15 (1) ◽  
pp. 52
Author(s):  
Chit Wityi Oo ◽  
Masahiro Shioji ◽  
Hiroshi Kawanabe ◽  
Susan A. Roces ◽  
Nathaniel P. Dugos
Keyword(s):  
Diesel Engine ◽  
Kinetic Model ◽  
Ignition Delay ◽  
National Laboratory ◽  
Chemical Species ◽  
Negative Temperature ◽  
Reaction Model ◽  
Reaction Products ◽  
Surrogate Fuels ◽  
Biodiesel Fuels

The biodiesel surrogate fuels are realistic kinetic tools to study the combustion of actual biodiesel fuels in diesel engines. The knowledge of fuel chemistry aids in the development of combustion modeling. In order to numerically simulate the diesel combustion, it is necessary to construct a compact reaction model for describing the chemical reaction. This study developed a skeletal kinetic model of methyl decanoate (MD) and n-heptane as a biodiesel surrogate blend for the chemical combustion reactions. The skeletal kinetic model is simply composed of 45 chemical species and 74 reactions based on the full kinetic models which have been developed by Lawrance Livermore National Laboratory (LLNL) and Knowledge-basing Utilities for Complex Reaction Systems (KUCRS) under the diesel like engine conditions. The model in this study is generated by using CHEMKIN and then it is used to produce the ignition delay data and the related chemical species. The model predicted good reasonable agreement for the ignition delays and most of the reaction products at various conditions. The chemical species are well reproduced by this skeletal kinetic model while the good temperature dependency is found under constant pressure conditions 2MPa and 4MPa. The ignition delay time of present model is slightly shorter than the full kinetic model near negative temperature coefficient (NTC) regime. This skeletal model can provide the chemical kinetics to apply in the simulation codes for diesel-engine combustion.

Formulation of Sasol Isomerized Paraffinic Kerosene Surrogate Fuel for Diesel Engine Application Using an Ignition Quality Tester

2017 ◽  
Vol 139 (9) ◽  
Author(s):  
Ziliang Zheng ◽  
Tamer Badawy ◽  
Naeim Henein ◽  
Peter Schihl ◽  
Eric Sattler
Keyword(s):  
Diesel Engine ◽  
Ignition Delay ◽  
Alternative Fuels ◽  
Internal Combustion Engines ◽  
Cetane Number ◽  
Surrogate Fuels ◽  
Cycle Simulation ◽  
Ignition Quality ◽  
Surrogate Fuel ◽  
Ignition Quality Tester

Sasol isomerized paraffinic kerosene (IPK) is a coal-derived synthetic fuel under consideration as a blending stock with jet propellant 8 (JP-8) for use in military equipment. However, Sasol IPK is a low ignition quality fuel with derived cetane number (DCN) of 31. The proper use of such alternative fuels in internal combustion engines (ICEs) requires the modification in control strategies to operate engines efficiently. With computational cycle simulation coupled with surrogate fuel mechanism, the engine development process is proved to be very effective. Therefore, a methodology to formulate Sasol IPK surrogate fuels for diesel engine application using ignition quality tester (IQT) is developed. An in-house developed matlab code is used to formulate the appropriate mixture blends, also known as surrogate fuel. And aspen hysys is used to emulate the distillation curve of the surrogate fuels. The properties of the surrogate fuels are compared to those of the target Sasol IPK fuel. The DCNs of surrogate fuels are measured in the IQT and compared with the target Sasol IPK fuel at the standard condition. Furthermore, the ignition delay, combustion gas pressure, and rate of heat release (RHR) of Sasol IPK and its formulated surrogate fuels are analyzed and compared at five different charge temperatures. In addition, the apparent activation energies derived from chemical ignition delay of the surrogate fuel and Sasol IPK are determined and compared.

scholarly journals Ignition delay and its influence on the performance of a Diesel engine operating with different Diesel–biodiesel fuels

2021 ◽  
Vol 7 ◽  
pp. 5483-5494
Author(s):  
Lucian Miron ◽  
Radu Chiriac ◽  
Marek Brabec ◽  
Viorel Bădescu
Keyword(s):  
Diesel Engine ◽  
Ignition Delay ◽  
Biodiesel Fuels

Predicting the Physical and Chemical Ignition Delays in a Military Diesel Engine Running n-Hexadecane Fuel

2014 ◽  
Vol 136 (7) ◽  
Author(s):  
Len Hamilton ◽  
Dianne Luning Prak ◽  
Jim Cowart
Keyword(s):  
Diesel Engine ◽  
Ignition Delay ◽  
Lawrence Livermore National Laboratory ◽  
National Laboratory ◽  
Kinetic Mechanism ◽  
Chemical Kinetic ◽  
Combustible Mixture ◽  
Load Range ◽  
Modeling Tools ◽  
Start Of Injection

There are currently numerous efforts to create renewable fuels that have similar properties to conventional diesel fuels. One major future challenge is evaluating how these new fuels will function in older legacy diesel engines. It is desired to have physically based modeling tools that will predict new fuel performance without extensive full scale engine testing. This study evaluates two modeling tools that are used together to predict ignition delay in a military diesel engine running n-hexadecane as a fuel across the engine's speed-load range. AVL-FIRE® is used to predict the physical delay of the fuel from the start of injection until the formation of a combustible mixture. Then a detailed Lawrence Livermore National Laboratory (LLNL) chemical kinetic mechanism is used to predict the chemical ignition delay. This total model predicted ignition delay is then compared to the experimental engine data. The combined model predicted results show good agreement to that of the experimental data across the engine operating range with the chemical delay being a larger fraction of the total ignition delay. This study shows that predictive tools have the potential to evaluate new fuel combustion performance.

Formulation of Sasol IPK Surrogate Fuel for Diesel Engine Application Using an Ignition Quality Tester (IQT)

2016 ◽  
Author(s):  
Ziliang Zheng ◽  
Tamer Badawy ◽  
Naeim Henein ◽  
Peter Schihl ◽  
Eric Sattler
Keyword(s):  
Diesel Engine ◽  
Ignition Delay ◽  
Cetane Number ◽  
Combustion Gas ◽  
Surrogate Fuels ◽  
Aspen Hysys ◽  
Ignition Quality ◽  
Apparent Activation Energies ◽  
Surrogate Fuel ◽  
Ignition Quality Tester

This paper presents an approach to develop Sasol IPK (Iso-Paraffinic Kerosene) surrogate fuels for diesel engine application using Ignition Quality Tester (IQT). The methodology includes: 1) in-house developed MATLAB code to formulate the appropriate mixture blends, 2) Aspen HYSYS to develop the distillation curve and compares it to the target Sasol IPK fuel, 3) IQT to measure the derived cetane number (DCN) of surrogate fuels and compare it with the target Sasol IPK fuel, 4) analysis of autoignition and combustion characteristics for Sasol IPK surrogate fuels. The ignition delay, combustion gas pressure, and rate of heat release of Sasol IPK and its formulated surrogate fuel are analyzed and compared at five different charge temperatures. Furthermore, the apparent activation energies derived from chemical ignition delay of the surrogate fuel and Sasol IPK are determined and compared.

Comparative analysis on the effects of diesel particulate filter and selective catalytic reduction systems on a wide spectrum of chemical species emissions

2018 ◽  
Author(s):  
Z. Gerald Liu ◽  
Devin R. Berg ◽  
Thaddeus A. Swor ◽  
James J. Schauer‡
Keyword(s):  
Diesel Engine ◽  
Selective Catalytic Reduction ◽  
Diesel Particulate Filter ◽  
Catalytic Reduction ◽  
Wide Spectrum ◽  
Chemical Species ◽  
Pollutant Emissions ◽  
Particulate Filter ◽  
Diesel Particulate ◽  
Aftertreatment Systems

Two methods, diesel particulate filter (DPF) and selective catalytic reduction (SCR) systems, for controlling diesel emissions have become widely used, either independently or together, for meeting increasingly stringent emissions regulations world-wide. Each of these systems is designed for the reduction of primary pollutant emissions including particulate matter (PM) for the DPF and nitrogen oxides (NOx) for the SCR. However, there have been growing concerns regarding the secondary reactions that these aftertreatment systems may promote involving unregulated species emissions. This study was performed to gain an understanding of the effects that these aftertreatment systems may have on the emission levels of a wide spectrum of chemical species found in diesel engine exhaust. Samples were extracted using a source dilution sampling system designed to collect exhaust samples representative of real-world emissions. Testing was conducted on a heavy-duty diesel engine with no aftertreatment devices to establish a baseline measurement and also on the same engine equipped first with a DPF system and then a SCR system. Each of the samples was analyzed for a wide variety of chemical species, including elemental and organic carbon, metals, ions, n-alkanes, aldehydes, and polycyclic aromatic hydrocarbons, in addition to the primary pollutants, due to the potential risks they pose to the environment and public health. The results show that the DPF and SCR systems were capable of substantially reducing PM and NOx emissions, respectively. Further, each of the systems significantly reduced the emission levels of the unregulated chemical species, while the notable formation of new chemical species was not observed. It is expected that a combination of the two systems in some future engine applications would reduce both primary and secondary emissions significantly.

Ignition Characteristics of a Fischer-Tropsch Synthetic Jet Fuel

2008 ◽  
Author(s):  
P. Gokulakrishnan ◽  
M. S. Klassen ◽  
R. J. Roby
Keyword(s):  
Kinetic Model ◽  
Ignition Delay ◽  
Flow Reactor ◽  
Kinetic Mechanism ◽  
Jet Fuel ◽  
Synthetic Jet ◽  
Jet Fuels ◽  
Ignition Delay Times ◽  
Delay Times ◽  
Ignition Characteristics

Ignition delay times of a “real” synthetic jet fuel (S8) were measured using an atmospheric pressure flow reactor facility. Experiments were performed between 900 K and 1200 K at equivalence ratios from 0.5 to 1.5. Ignition delay time measurements were also performed with JP8 fuel for comparison. Liquid fuel was prevaporized to gaseous form in a preheated nitrogen environment before mixing with air in the premixing section, located at the entrance to the test section of the flow reactor. The experimental data show shorter ignition delay times for S8 fuel than for JP8 due to the absence of aromatic components in S8 fuel. However, the ignition delay time measurements indicate higher overall activation energy for S8 fuel than for JP8. A detailed surrogate kinetic model for S8 was developed by validating against the ignition delay times obtained in the present work. The chemical composition of S8 used in the experiments consisted of 99.7 vol% paraffins of which approximately 80 vol% was iso-paraffins and 20% n-paraffins. The detailed kinetic mechanism developed in the current work included n-decane and iso-octane as the surrogate components to model ignition characteristics of synthetic jet fuels. The detailed surrogate kinetic model has approximately 700 species and 2000 reactions. This kinetic mechanism represents a five-component surrogate mixture to model generic kerosene-type jets fuels, namely, n-decane (for n-paraffins), iso-octane (for iso-paraffins), n-propylcyclohexane (for naphthenes), n-propylbenzene (for aromatics) and decene (for olefins). The sensitivity of iso-paraffins on jet fuel ignition delay times was investigated using the detailed kinetic model. The amount of iso-paraffins present in the jet fuel has little effect on the ignition delay times in the high temperature oxidation regime. However, the presence of iso-paraffins in synthetic jet fuels can increase the ignition delay times by two orders of magnitude in the negative temperature (NTC) region between 700 K and 900 K, typical gas turbine conditions. This feature can have a favorable impact on preventing flashback caused by the premature autoignition of liquid fuels in lean premixed prevaporized (LPP) combustion systems.

scholarly journals Formation of flavorant–propylene Glycol Adducts With Novel Toxicological Properties in Chemically Unstable E-Cigarette Liquids

2018 ◽  
Vol 21 (9) ◽  
pp. 1248-1258 ◽  
Author(s):  
Hanno C Erythropel ◽  
Sairam V Jabba ◽  
Tamara M DeWinter ◽  
Melissa Mendizabal ◽  
Paul T Anastas ◽  
...  
Keyword(s):  
Propylene Glycol ◽  
Electronic Cigarettes ◽  
Aqueous Media ◽  
Chemical Species ◽  
Resonance Spectroscopy ◽  
Reaction Products ◽  
Chemical Systems ◽  
Toxicological Effects ◽  
Wide Range ◽  
Irritant Receptors

Abstract Introduction “Vaping” electronic cigarettes (e-cigarettes) is increasingly popular with youth, driven by the wide range of available flavors, often created using flavor aldehydes. The objective of this study was to examine whether flavor aldehydes remain stable in e-cigarette liquids or whether they undergo chemical reactions, forming novel chemical species that may cause harm to the user. Methods Gas chromatography was used to determine concentrations of flavor aldehydes and reaction products in e-liquids and vapor generated from a commercial e-cigarette. Stability of the detected reaction products in aqueous media was monitored by ultraviolet spectroscopy and nuclear magnetic resonance spectroscopy, and their effects on irritant receptors determined by fluorescent calcium imaging in HEK-293T cells. Results Flavor aldehydes including benzaldehyde, cinnamaldehyde, citral, ethylvanillin, and vanillin rapidly reacted with the e-liquid solvent propylene glycol (PG) after mixing, and upward of 40% of flavor aldehyde content was converted to flavor aldehyde PG acetals, which were also detected in commercial e-liquids. Vaping experiments showed carryover rates of 50%–80% of acetals to e-cigarette vapor. Acetals remained stable in physiological aqueous solution, with half-lives above 36 hours, suggesting they persist when inhaled by the user. Acetals activated aldehyde-sensitive TRPA1 irritant receptors and aldehyde-insensitive TRPV1 irritant receptors. Conclusions E-liquids are potentially reactive chemical systems in which new compounds can form after mixing of constituents and during storage, as demonstrated here for flavor aldehyde PG acetals, with unexpected toxicological effects. For regulatory purposes, a rigorous process is advised to monitor the potentially changing composition of e-liquids and e-vapors over time, to identify possible health hazards. Implications This study demonstrates that e-cigarette liquids can be chemically unstable, with reactions occurring between flavorant and solvent components immediately after mixing at room temperature. The resulting compounds have toxicological properties that differ from either the flavorants or solvent components. These findings suggest that the reporting of manufacturing ingredients of e-liquids is insufficient for a safety assessment. The establishment of an analytical workflow to detect newly formed compounds in e-liquids and their potential toxicological effects is imperative for regulatory risk analysis.

Proportional–Integral Controller Design for Combustion-Timing Feedback, From n-Heptane to Iso-Octane in Compression–Ignition Engines

2017 ◽  
Vol 140 (5) ◽  
Author(s):  
Gabriel Ingesson ◽  
Lianhao Yin ◽  
Rolf Johansson ◽  
Per Tunestål
Keyword(s):  
Ignition Delay ◽  
Controller Design ◽  
Negative Temperature ◽  
Operating Conditions ◽  
Measurement Noise ◽  
Noise Sensitivity ◽  
Proportional Integral ◽  
Primary Reference ◽  
The Difference ◽  
Primary Reference Fuels

The problem of designing robust and noise-insensitive proportional–integral (PI) controllers for pressure-sensor-based combustion-timing control was studied through simulation. Different primary reference fuels (PRF) and operating conditions were studied. The simulations were done using a physics-based, control-oriented model with an empirical ignition-delay correlation. It was found that the controllable region in between the zero-gain region for early injection timings and the misfire region for late injection timings is strongly PRF dependent. As a result, it was necessary to adjust intake temperature to compensate for the difference in fuel reactivity prior to the controller design. With adjusted intake temperature, PRF-dependent negative-temperature coefficient (NTC) behavior gave different system characteristics for the different fuels. The PI controller design was accomplished by solving the optimization problem of maximizing disturbance rejection and tracking performance subject to constraints on robustness and measurement-noise sensitivity. Optimal controller gains were found to be limited by the high system gain at late combustion timings and high-load conditions; furthermore, the measurement-noise sensitivity was found to be higher at the low-load operating points where the ignition delay is more sensitive to variations in load and intake conditions. The controller-gain restrictions were found to vary for the different PRFs; the optimal gains for higher PRFs were lower due to a higher system gain, whereas the measurement-noise sensitivity was found to be higher for lower PRFs.

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