Fluid Phase Equilibria, Vol.161, No.2, 271-281, 1999
Modified combinatorial factor in the hole theory
To describe the behavior of liquid state by hole theory, Flory's combinatorial factor used in the partition function of the hole theory is modified in a general form by assuming that unit segment of chain molecule can occupy more than one unit cell or lattice. From this combinatorial factor and free volume expression, a new equation of state is derived, and is used to calculate the PVT behaviors of 10 pure low molecular weight liquid systems. In addition, the PVT behavior of carbontetrachloride/cyclohexane binary system is calculated. Good agreements between the theory and experimental data are obtained.