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This paper presents a new chemical kinetic model developed for the simulation of auto-ignition and combustion of engine surrogate fuel mixtures sensitized by the presence of NOx. The chemical mechanism is based on the PRF auto-ignition…

Chemical Physics · Physics 2009-03-26 Jörg Anderlohr , A. Pires Da Cruz , Roda Bounaceur , Frédérique Battin-Leclerc

Autoignition delay experiments for the isomers of butanol, including n-, sec-, tert-, and iso-butanol, have been performed using a heated rapid compression machine. For a compressed pressure of 15 bar, the compressed temperatures have been…

Chemical Physics · Physics 2017-06-07 Bryan W. Weber , Kamal Kumar , Chih-Jen Sung

The thermal decomposition of n-dodecane, a component of some jet fuels, has been studied in a jet-stirred reactor at temperatures from 793 to 1093 K, for residence times between 1 and 5 s and at atmospheric pressure. Thermal decomposition…

In order to better understand the chemistry involved during the combustion of components of diesel fuel, the structure of a laminar lean premixed methane flame doped with indane has been investigated. The gases of this flame contains 7.1%…

Chemical Physics · Physics 2009-03-26 Emir Pousse , Pierre-Alexandre Glaude , René Fournet , Frédérique Battin-Leclerc

The present study is devoted to the detailed numerical analysis of the combustion waves propagation through the lean hydrogen-air mixtures with suspended micro-droplets of water. Considered gaseous mixtures are characterized by a relatively…

Fluid Dynamics · Physics 2019-09-20 I. S. Yakovenko , A. D. Kiverin

In this work, oblique detonation of n-heptane/air mixture in high-speed wedge flows is simulated by solving the reactive Euler equations with a two-dimensional (2D) configuration. This is a first attempt to model complicated hydrocarbon…

Fluid Dynamics · Physics 2022-02-11 Hongbo Guo , Yong Xu , Hongtao Zheng , Huangwei Zhang

Utilization of liquid fuels is crucial to enabling commercialization of rotating detonation engines in the near future. In this study, Eulerian-Lagrangian simulations are conducted for rotating detonative combustion with dilute n-heptane…

Fluid Dynamics · Physics 2022-02-15 Shan Jin , Chao Xu , Hongtao Zheng , Huangwei Zhang

Butanol, an alcohol which can be produced from biomass sources, has received recent interest as an alternative to gasoline for use in spark ignition engines and as a possible blending compound with fossil diesel or biodiesel. Therefore, the…

Auto-ignition process of stoichiometric mixture of methane-air is investigated using detailed chemical kinetics in a single-zone combustion chamber. Effect of initial temperature on start of combustion (SOC). The Arrhenius expression for…

Chemical Physics · Physics 2017-12-08 Bagher Abareshi , Hassan Mohagheghi , Morteza Khosronia Kalalabadi

Investigation of the autoignition delay of the butanol isomers has been performed at elevated pressure of 15 bar and low to intermediate temperatures of 725-870 K. Stoichiometric mixtures made in nitrogen/oxygen air were studied. For the…

Chemical Physics · Physics 2017-06-07 Bryan W. Weber , Chih-Jen Sung

Design and operation of advanced reactors such as fuel reformers require reliable micro-kinetic models that capture the dynamics of the reaction. The negative temperature coefficient phenomenon causes a reduction in mixture temperature for…

Understanding the mechanisms of explosions is important for minimizing devastating hazards. Due to the complexity of real chemistry, a single-step reaction mechanism is usually used for theoretical and numerical studies. The purpose of this…

Chemical Physics · Physics 2019-07-24 Mikhail Liberman , Cheng Wang , Chengeng Qian , JianNan Liu

This experimental study addresses the re-initiation mechanism of detonation waves following the Mach reflection of a shock-flame complex. The detonation diffraction around a cylinder is used to reproducibly generate the shock-flame complex…

Weak detonations have remained experimentally elusive since their theoretical prediction, with previous realization attempts requiring either pathological detonations or Zeldovich spontaneous waves. Here, we demonstrate that stable weak…

Fluid Dynamics · Physics 2025-07-15 Youhi Morii , Kaoru Maruta

High temeperature (900-1000\degree C) low pressure (<< 1 atm) pyrolysis of propane yields a pyrocarbon deposit, but also mainly hydrogen and hydrocarbons from methane to polyaromatics. 30 reaction products were exeperimentally quantified at…

Chemical Physics · Physics 2009-04-28 Isabelle Ziegler-Devin , René Fournet , Paul-Marie Marquaire

For a better modeling of the importance of the different channels leading to the first aromatic ring, we have compared the structures of laminar rich premixed methane flames doped with several unsaturated hydrocarbons: allene and propyne,…

Different simplified and detailed chemical models and their impact on simulations of combustion regimes initiating by the initial temperature gradient in methane/air mixtures are studied. The limits of the regimes of reaction wave…

Chemical Physics · Physics 2018-11-20 Cheng Wang , Chengeng Qian , JianNan Liu , Mikhail A. Liberman

This paper provides detailed comparisons of chemical reaction mechanisms of H2 applicable at high preheat temperatures and pressures relevant to gas turbine and particularly Alstom's reheat gas turbine conditions. It is shown that the…

Chemical Physics · Physics 2011-04-27 Torleif Weydahl , Madhavan Poyyapakkam , Morten Seljeskog , Nils Erland L. Haugen

In line with the study presented in the part I of this paper, the structure of a laminar rich premixed methane flame doped with 1,3-butadiene has been investigated. The flame contains 20.7% (molar) of methane, 31.4% of oxygen and 3.3% of…

39 detailed mechanisms for combustion of hydrogen, carbon monoxide and methanol are investigated using ReactionKinetics, a Mathematica based package. The obtained results in most cases do not depend on the choice of reaction rate…

Chemical Physics · Physics 2013-08-06 J. Tóth , A. L. Nagy , I. Zsély