Title of article :
Describing the Properties of Chains of Segments IInteracting Via Soft-Core Potentials of Variable Range with the SAFT-VR Approach
Author/Authors :
L. A. Davies، نويسنده , , A. Gil-Villegas and G. Jackson ، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 1998
Abstract :
We present a general development for the equation of state (EOS) of chain
molecules composed of tangent spherical segments iInteracting with a soft repulsive
potential and an attractive well. The method is based on a recent version
of the statistical associating fluid theory for chain molecules with iInteraction
potentials of variable range (SAFT-VR). In this communication we focus our
attention on the properties of Lennard-Jones chains (LJC), using SAFT-VR
and a sample recipe for the evaluation of the chain free energy that requires only
a knowledge of the contact value of the cavity function of a Sutherland-6
system. We study the liquid-vapor coexistence properties for different values of
the chain length. The results obtained are of similar accuracy to other EOS for
LJC, but our approach is simpler and more general. We show that standard
perturbation theories developed for simple liquids can also be used for chain
molecules.
Keywords :
associating fluids , chain molecules , Lennard-Jones , SAFT.
Journal title :
International Journal of Thermophysics
Journal title :
International Journal of Thermophysics