• International Journal of Aeronautical and Space Sciences
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• v.16 no.3
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• pp.347-359
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• 2015

A method of describing the rovibrational energy transitions and coupled chemical reactions in the direct simulation Monte Carlo (DSMC) calculations is constructed for $H(^2S)+H_2(X^1{\Sigma}_g)$ and $He(^1S)+H_2(X^1{\Sigma}_g)$. First, the state-specific total cross sections for each rovibrational states are proposed to describe the state-resolved elastic collisions. The state-resolved method is constructed to describe the rotational-vibrational-translational (RVT) energy transitions and coupled chemical reactions by these state-specific total cross sections and the rovibrational state-to-state transition cross sections of bound-bound and bound-free transitions. The RVT energy transitions and coupled chemical reactions are calculated by the state-resolved method in various heat bath conditions without relying on a macroscopic properties and phenomenological models of the DSMC. In nonequilibrium heat bath calculations, the state-resolved method are validated with those of the master equation calculations and the existing shock-tube experimental data. In bound-free transitions, the parameters of the existing chemical reaction models of the DSMC are proposed through the calibrations in the thermochemical nonequilibrium conditions. When the bound-free transition component of the state-resolved method is replaced by the existing chemical reaction models, the same agreement can be obtained except total collision energy model.

• Journal of the Korean Physical Society
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• v.73 no.10
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• pp.1519-1528
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• 2018

The objective of the present study is the development of a comprehensive air chemical kinetic model that includes 11 species and 54 chemical reactions for the numerical investigation of air nonequilibrium inductively coupled plasmas. The two-dimensional, compressible Navier-Stokes equations coupled with the electromagnetic-field equations were employed to describe the fundamental characteristics of an inductive plasma. Dunn-Kangs 32 chemical-reaction model of air was reconstructed and used as a comparative model. The effects of the different chemical kinetic models on the flow field were analyzed and discussed at identical/different working pressures. The results theoretically indicate that no matter the working pressure is low or high, the use of the 54 chemical kinetic model presented in this study is a better choice for the numerical simulation of a nonequilibrium air ICP.

• Journal of applied mathematics & informatics
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• v.9 no.1
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• pp.1-13
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• 2002

In this paper we present numerical methods fur computations of nonequilibrium hypersonic flow of air around bodies including chemical reaction effects and present numerical result of the flow over concave corners. We developed implicit finite difference method to overcome numerical difficulties with the lack of resolution behind the shock and near the body. Using our method we were able to find details of the flow properties near the shock and body and were able to continue the computation of the flow for a long distance from the corner of the body.

• Journal of computational fluids engineering
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• v.17 no.4
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• pp.69-74
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• 2012

Hypersonic flowfields over a sphere is calculated by using a nonequilibrium flow solver. The flow solver features a two-temperature model and finite rate chemical reaction models to describe nonequilibrium thermochemical processes. For the purpose of validation, the calculated shock stand-off distance is compared with the experimental data which is measured in a ballistic range facility. The present nonequilibrium calculation well reproduced the experimental shock stand-off distance in the cases where the experimental flowfields are expected to be nearly equilibrium, as well as in the cases to be nonequilibrium flowfields in the velocity range 4000 to 5500 m/s.

• Communications of the Korean Mathematical Society
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• v.10 no.3
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• pp.767-781
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• 1995

In this paper we present computation of a reflected shock in the hypersonic flow of air with chemical reactions. We consider two dimensional steady inviscid hypersonic flow of air around bodies including chemical reaction effects. At a high Mach number, a strong shock is formed in front of the body when a wedge is placed against the flow. In front of the shock, temperature and pressure increase greatly and the flow is in nonequilibrium state. If the shock hits a wall, then a reflected shock is formed in the nonequilibrium flow region. Behind this reflected shock, the temperature and pressure are very high. We carry out the computation of the reflected shock and the flow behind it. The jump conditions at the reflected shock are presented. A technique combining smooth transforms of domain and implicit difference methods is used to overcome numerical difficulties associated with the lack of resolution behind the shock and near the body.

• Journal of Advanced Marine Engineering and Technology
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• v.30 no.8
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• pp.853-862
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• 2006

The present study is numerically investigated the flame structure of non-premixed counterflow jet flames using the laminar flamelet model Detailed flame structures with the fuel composition of 40% CO, 30% $H_2$. 30% $N_2$ and an oxidizer composition of 79% $N_2$ and 21% $O_2$ in a non-premixed counterflow flame are studied numerically. This study is aimed to investigate the effects of axial velocity gradient and combustion atmosphere pressure on flame structure. The results show that the role of axial velocity gradient on combustion processes is globally opposite to that of combustion atmosphere pressure. That is, chemical nonequilibrium effects become dominant with increasing axial velocity gradient, but are suppressed with increasing ambient pressure. Also, the flame strength is globally weakened by the increase of axial velocity gradient but is augmented by the increase of ambient pressure. However, flame extinction is described better on the basis of only chemical reaction and in this study axial velocity gradient and ambient pressure play a similar role conceptually such that the increase of axial velocity gradient and ambient pressure cause flame not to be extinguished and extend the extinction limit, respectively. Consequently it is suggested that a combustion process like flame extinction is mainly influenced by the competition between the radical formation reaction and the third-body recombination reaction.

• Bulletin of the Korean Chemical Society
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• v.26 no.12
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• pp.1986-1990
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• 2005

We study the relaxation kinetics of reversible reactions of the type A + B $^\leftarrow_\rightarrow$ C + B by applying the manyparticle kernel theory, which we have developed to investigate many particle effects on general diffusioninfluenced reactions. It is shown that for the target model, where A and C molecules are immobile and their interconversion is induced by the encounter with the B molecules that are present in much excess, the manyparticle kernel theory gives a result that coincides with the known exact result.

• Proceedings of the Korean Society of Propulsion Engineers Conference
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• 2001.11a
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• pp.43-47
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• 2001

A numerical parametric study is conducted to simulate shock-induced combustion with a variation in freestream conditions. The analysis is limited to inviscid flow and includes chmical nonequilibrium. A steady combustion front is established if the freestream Mach number is above the Chapman-Jouguet speed of the mixture. On the other, an unsteady reaction fi:ont is established if the freestream Mach number is below or at the Chapman-Jouguet speed of the mixture. The three cases have been simulated for Machs 4.18, 5.11, and 6.46 with a projectile diameter of 15 mm. Machs 4.18 and 5.11 shows an unsteady reaction front, whereas Mach 6.46 represents a steady reaction front. Thus Chapman-Jouguet speed is one of deciding factor for the instabilities to trigger. The instabilities of the chemical front with a variation of projectiles diameters will be investigated.

• Journal of Energy Engineering
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• v.2 no.1
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• pp.54-67
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• 1993

Two turbulent reaction models of the premixed CC1$_4$/CH$_4$/air mixture are successfully incorporated in a 3-dimensional computer program and is applied for Dow Chemical incinerator equipped with two main off-center burners. The first reaction model is fast chemistry model(model 1), in which chemical reaction is governed by the turbulent mixing itself. And the second one is nonequilibrium model(model 2), where the effect of the chemical kinetics due to the presence of CC1$_4$is considered by the incorporation of the burning velocity data of CC1$_4$. The second model not only shows the flame inhibition trend due to the presence CC1$_4$compound, but also predicts qualitatively the vortical stratification of the CC1$_4$concentration appeared experimentally at the kiln exit. Other comparisions of two models are made in detail.

• Journal of the Speleological Society of Korea
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• no.76
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• pp.37-42
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• 2006

The Dielectric Barrier Discharge (DBD) is a nonequilibrium gas discharge that is generated in the space between two electrodes, which are separated by an insulating dielectric layer. The dielectric layer can be put on either of the two electrodes or be inserted in the space between two electrodes. If an AC or pulse high voltage is applied to the electrodes that is operated at applied frequency from 50Hz to several MHz and applied voltages from a few to a few tens of kilovolts rms, the breakdown can occur in working gas, resulting in large numbers of micro-discharges across the gap, the gas discharge is the so called DBD. Compared with most other means for nonequilibrium discharges, the main advantage of the DBD is that active species for chemical reaction can be produced at low temperature and atmospheric pressure without the vacuum set up, it also presents many unique physical and chemical process including light, heat, sound and electricity. This has led to a number of important applications such as ozone synthesizing, UV lamp house, CO2 lasers, et al. In recent years, due to its potential applications in plasma chemistry, semiconductor etching, pollution control, nanometer material and large area flat plasma display panels, DBD has received intensive attention from many researchers and is becoming a hot topic in the field of non-thermal plasma.