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化学势路径下粘性硬球流体的状态方程。

Equation of state of sticky-hard-sphere fluids in the chemical-potential route.

作者信息

Rohrmann René D, Santos Andrés

机构信息

Instituto de Ciencias Astronómicas, de la Tierra y del Espacio (ICATE-CONICET), Avenida España 1512 Sur, 5400 San Juan, Argentina.

Departamento de Física, Universidad de Extremadura, Badajoz, E-06071, Spain.

出版信息

Phys Rev E Stat Nonlin Soft Matter Phys. 2014 Apr;89(4):042121. doi: 10.1103/PhysRevE.89.042121. Epub 2014 Apr 14.

Abstract

The coupling-parameter method, whereby an extra particle is progressively coupled to the rest of the particles, is applied to the sticky-hard-sphere fluid to obtain its equation of state in the so-called chemical-potential route (μ route). As a consistency test, the results for one-dimensional sticky particles are shown to be exact. Results corresponding to the three-dimensional case (Baxter's model) are derived within the Percus-Yevick approximation by using different prescriptions for the dependence of the interaction potential of the extra particle on the coupling parameter. The critical point and the coexistence curve of the gas-liquid phase transition are obtained in the μ route and compared with predictions from other thermodynamics routes and from computer simulations. The results show that the μ route yields a general better description than the virial, energy, compressibility, and zero-separation routes.

摘要

耦合参数法是将一个额外粒子逐步与其余粒子耦合,应用于粘性硬球流体,以在所谓的化学势路径(μ路径)中获得其状态方程。作为一致性检验,一维粘性粒子的结果被证明是精确的。通过对额外粒子的相互作用势与耦合参数的依赖关系使用不同的规定,在珀西-耶维克近似下得出了三维情况(巴克斯特模型)的结果。在μ路径中获得了气液相变的临界点和共存曲线,并与其他热力学路径和计算机模拟的预测结果进行了比较。结果表明,与维里、能量、压缩性和零分离路径相比,μ路径通常能给出更好的描述。

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