Canonical form and mathematical interpretation of electrolyte solution systems

被引:4
作者
Yoo, KY [1 ]
He, JW [1 ]
Amundson, NR [1 ]
机构
[1] Univ Houston, Dept Math, Houston, TX 77204 USA
关键词
electrolyte solution; canonical form; solid-liquid equilibrium; Lagrange multiplier; inorganic aerosol;
D O I
10.1007/BF02705413
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
We describe a canonical form of electrolyte solution systems for the mathematical interpretation of solid-liquid equilibrium. The canonical form is obtained from the analysis of the algebraic structure of electrolyte solution systems and the Karush-Kuhn-Tucker (KKT) conditions for the minimization of the total Gibbs free energy. As a result, the mathematical role of solid species in the solid-liquid equilibrium problem is explained as a Lagrange multiplier of a sort of the linearly constrained optimization problem. This finding will add to the development of an efficient numerical algorithm for the simulation of electrolyte solution systems.
引用
收藏
页码:303 / 307
页数:5
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