A modified PC‐SAFT equation of state for water which includes an association dependent hard sphere diameter

AIChE Journal ◽  
2021 ◽  
Author(s):  
Bennett D. Marshall
Keyword(s):  
Equation Of State ◽  
Hard Sphere ◽  
Sphere Diameter

Generalized van der Waals theory. IV. Variational determination of the hard-sphere diameter

1981 ◽  
Vol 34 (9) ◽  
pp. 1809 ◽  
Author(s):  
MA Hooper ◽  
S Nordholm
Keyword(s):  
Equation Of State ◽  
Hard Sphere ◽  
Pair Correlation ◽  
Van Der Waals ◽  
Critical Parameters ◽  
Variational Parameter ◽  
Sphere Diameter ◽  
Entropy Functional ◽  
Van Der Waals Theory

The generalized van der Waals theory is here extended by incorporating the hard-sphere diameter as a variational parameter. Moreover, the entropy functional has been chosen so as to accurately reflect the density dependence of the excluded volume revealed by the hard-sphere equation of state. The combined effect of these two improvements yields a theory capable of describing the equation of state of the Lennard- Jones model of classical fluids to an accuracy comparable to that of the pair correlation theories. The results presented here include critical parameters and coexistence and vapour pressure curves.

Critical consolute point in hard-sphere binary mixtures: Effect of the value of the eighth and higher virial coefficients on its location

2010 ◽  
Vol 75 (3) ◽  
pp. 359-369 ◽  
Author(s):  
Mariano López De Haro ◽  
Anatol Malijevský ◽  
Stanislav Labík
Keyword(s):  
Equation Of State ◽  
Binary Mixtures ◽  
Hard Sphere ◽  
Hard Spheres ◽  
Virial Coefficients ◽  
Fluid Mixture ◽  
Binary Fluid ◽  
Virial Series ◽  
Consolute Point ◽  
Critical Constants

Various truncations for the virial series of a binary fluid mixture of additive hard spheres are used to analyze the location of the critical consolute point of this system for different size asymmetries. The effect of uncertainties in the values of the eighth virial coefficients on the resulting critical constants is assessed. It is also shown that a replacement of the exact virial coefficients in lieu of the corresponding coefficients in the virial expansion of the analytical Boublík–Mansoori–Carnahan–Starling–Leland equation of state, which still leads to an analytical equation of state, may lead to a critical consolute point in the system.

Equation of state and correlation function contact values of a hard sphere mixture

2000 ◽  
Vol 98 (15) ◽  
pp. 1005-1010 ◽  
Author(s):  
Douglas Henderson ◽  
Kwong-Yu Chan
Keyword(s):  
Correlation Function ◽  
Equation Of State ◽  
Hard Sphere
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