mixture fraction

Mixture fraction (Z) is a quantity used in combustion studies that measures the mass fraction of one stream of a mixture formed by two feed streams, one the fuel stream and the other the oxidizer stream.Williams, F. A. (2018). Combustion theory. CRC Press.Peters, N. (2001). Turbulent combustion. Both the feed streams are allowed to have inert gases.Peters, N. (1992). Fifteen lectures on laminar and turbulent combustion. Ercoftac Summer School, 1428, 245. The mixture fraction definition is usually normalized such that it approaches unity in the fuel stream and zero in the oxidizer stream.Liñán, A., & Williams, F. A. (1993). Fundamental aspects of combustion. The mixture-fraction variable is commonly used as a replacement for the physical coordinate normal to the flame surface, in nonpremixed combustion.

Definition

Assume a two-stream problem having one portion of the boundary the fuel stream with fuel mass fraction Y_F=Y_{F,F} and another portion of the boundary the oxidizer stream with oxidizer mass fraction Y_{O}=Y_{O,O}. For example, if the oxidizer stream is air and the fuel stream contains only the fuel, then Y_{O,O}=0.232 and Y_{F,F}=1. In addition, assume there is no oxygen in the fuel stream and there is no fuel in the oxidizer stream. Let s be the mass of oxygen required to burn unit mass of fuel (for hydrogen gas, s=8 and for \mathrm{C}_m\mathrm{H}_n alkanes, s=32(m+n/4)/(12m+n)Fernández-Tarrazo, E., Sánchez, A. L., Linan, A., & Williams, F. A. (2006). A simple one-step chemistry model for partially premixed hydrocarbon combustion. Combustion and Flame, 147(1-2), 32-38.). Introduce the scaled mass fractions as y_F=Y_F/Y_{F,F} and y_O = Y_O/Y_{O,O}. Then the mixture fraction is defined as

:Z = \frac{Sy_F-y_{O}+1}{S+1}

where

:S = \frac{sY_{F,F}}{Y_{O,O}}

is the stoichiometry parameter, also known as the overall equivalence ratio. On the fuel-stream boundary, y_F=1 and y_O=0 since there is no oxygen in the fuel stream, and hence Z=1. Similarly, on the oxidizer-stream boundary, y_F=0 and y_O=1 so that Z=0. Anywhere else in the mixing domain, 0. The mixture fraction is a function of both the spatial coordinates \mathbf{x} and the time t, i.e., Z=Z(\mathbf{x},t).

Within the mixing domain, there are level surfaces where fuel and oxygen are found to be mixed in stoichiometric proportion. This surface is special in combustion because this is where a diffusion flame resides. Constant level of this surface is identified from the equation Z(\mathbf{x},t)=Z_s, where Z_s is called as the stoichiometric mixture fraction which is obtained by setting Y_F=Y_{O}=0 (since if they were react to consume fuel and oxygen, only on the stoichiometric locations both fuel and oxygen will be consumed completely) in the definition of Z to obtain

:Z_s = \frac{1}{S+1}.

Relation between local equivalence ratio and mixture fraction

When there is no chemical reaction, or considering the unburnt side of the flame, the mass fraction of fuel and oxidizer are y_{F,u}= Z and y_{O,u}= 1- Z (the subscript u denotes unburnt mixture). This allows to define a local fuel-air equivalence ratio \phi

:\phi= \frac{sY_{F,u}}{Y_{O,u}}=\frac{Sy_{F,u}}{y_{O,u}}.

The local equivalence ratio is an important quantity for partially premixed combustion. The relation between local equivalence ratio and mixture fraction is given by

:\phi = \frac{SZ}{1-Z} \qquad \Rightarrow \qquad Z = \frac{\phi}{S+\phi}.

The stoichiometric mixture fraction Z_s defined earlier is the location where the local equivalence ratio \phi=1.

Scalar dissipation rate

In turbulent combustion, a quantity called the scalar dissipation rate \chi with dimensional units of that of an inverse time is used to define a characteristic diffusion time. Its definition is given by

:\chi = 2 D |\nabla Z|^2

where D is the diffusion coefficient of the scalar. Its stoichiometric value is \chi_s = 2D_s|\nabla Z|^2_s.

Liñán's mixture fraction

Amable Liñán introduced a modified mixture fraction in 1991A. Liñán, The structure of diffusion flames, in Fluid Dynamical Aspects of Combustion Theory, M. Onofri and A. Tesei, eds., Harlow, UK. Longman Scientific and Technical, 1991, pp. 11–29Linán, A. (2001). Diffusion-controlled combustion. In Mechanics for a New Mellennium (pp. 487-502). Springer, Dordrecht. that is appropriate for systems where the fuel and oxidizer have different Lewis numbers. If Le_F and Le_{O_2} are the Lewis number of the fuel and oxidizer, respectively, then Liñán's mixture fraction is defined as

:\tilde Z = \frac{\tilde Sy_F-y_{O}+1}{\tilde S+1}

where

:\tilde S = \frac{Le_O S}{Le_F}.

The stoichiometric mixture fraction \tilde Z_s is given by

:\tilde Z_s = \frac{1}{\tilde S+1}.

References