Inversion of the Kirkwood-Buff theory of solutions: application to binary systems

被引:42
|
作者
Pandey, JD [1 ]
Verma, R [1 ]
机构
[1] Univ Allahabad, Dept Chem, Allahabad 211002, Uttar Pradesh, India
关键词
Kirkwood-Buff integrals; binary liquid mixtures; activity coefficients; excess volumes; regular mixtures;
D O I
10.1016/S0301-0104(01)00398-6
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Kirkwood-Buff (K-B) integrals play an important role in characterizing the properties and interactions of various liquid mixtures. However, there exists no method to calculate directly the K-B integrals from the easily available experimental data of ultrasonic velocity and density. An attempt has been made to evaluate the same using these initial parameters. A statistical mechanical theory advanced by Arakawa et al. has been used here, in combination with a semiempirical formula to compute K-B parameters in the whole concentration range for six binary systems at atmospheric pressure and at 298.15 K. (C) 2001 Elsevier Science BN. All rights reserved.
引用
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页码:429 / 438
页数:10
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