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An analytic equation-of-state for mixture of square-well chain fluids of variable well width
被引:9
|作者:
Paredes, MLL
Nobrega, R
Tavares, FW
机构:
[1] Univ Fed Rio de Janeiro, Escola Quim, BR-21949900 Rio De Janeiro, Brazil
[2] Univ Fed Rio de Janeiro, COPPE, Programa Engn Quim, BR-21945970 Rio De Janeiro, Brazil
关键词:
equation of state;
mixture;
polymer;
square-well fluid;
D O I:
10.1016/S0378-3812(00)00504-5
中图分类号:
O414.1 [热力学];
学科分类号:
摘要:
An analytic perturbation theory equation of state for a mixture of freely-jointed square-well fluids of variable well width (1 less than or equal to h less than or equal to 2) is developed. The equation of state is based on second-order Barker and Henderson perturbation theory to calculate the thermodynamic properties of the reference sphere fluid, and on first-order Wertheim thermodynamic perturbation theory to account for the connectivity of spheres to form chains. A real function expression for the radial distribution function of hard spheres and a one-fluid type mixing rule are used to obtain an analytic, closed-form expression, for the Helmohltz free energy of mixtures of square-well spheres. Good results were obtained when this equation of state was used with temperature-independent parameters to correlate vapor-liquid equilibrium data of pure substances and mixtures. (C) 2001 Elsevier Science B.V, All rights reserved.
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页码:231 / 243
页数:13
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