Example 05.20 Liquid-Liquid Equilibrium for the System Water – Ethanol – Benzene
K-Factor Method UNIQUAC
Calculate the liquid-liquid equilibrium composition for the system water (1) - ethanol (2) - benzene (3) for the following feed stream: n1 = 1 mol, n2 = 0.3 mol, and n3 = 1 mol at 25 °C with the help of the UNIQUAC model.
In the first step a convenient function to convert the mole flow vector into a mol fraction vector is defined:
The interaction parameter matrix Du is converted to the t matrix only once as temperature is constant in the calculation:
The following functions yield the logarithmic activity coefficient and activity coefficient vector using the UNIQUAC equation (Table 5.6):
For the K-factor method, an initial estimation of the mole flows in the first liquid outlet stream is required:
Now the K-factor function is used to calculate the mole flows in the first liquid outlet stream. The second liquid stream is found by solving the mass balance: