Calculation of Standard Thermodynamic Potentials for Na-Zeolites with the Use of Linear Programming Problems英文文献资料.docVIP

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Calculation of Standard Thermodynamic Potentials for Na-Zeolites with the Use of Linear Programming Problems英文文献资料.doc

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Calculation of Standard Thermodynamic Potentials for Na-Zeolites with the Use of Linear Programming Problems英文文献资料

International Journal of Geosciences, 2011, 2, 227-230 doi:10.4236/ijg.2011.23024 Published Online August 2011 (http://www.SciRP.org/journal/ijg) Calculation of Standard Thermodynamic Potentials for Na-Zeolites with the Use of Linear Programming Problems Oleg Viacheslavovich Yeriomin Establishment of the Russian Academy of Sciences, Institute of Natural Resources, Ecology, and Cryology, The Siberian Branch of the Russian Academy of Sciences, Chita, Russian Federation E-mail: yeroleg@yandex.ru Received April 1, 2011; revised June 2, 2011; accepted July 6, 2011 Abstract Linear programming problems for Na-Al-Si-O-H system have been formulated and solved for calculations of standard enthalpies and Gibbs potentials of zeolites with unknown thermodynamic properties. The calcula- tions are based on dual solutions of linear programming problems. Comparison of numerical results with published data gives relative mistakes of estimations less than one percent. On the basis of calculated poten- tials the standard entropies have been estimated. The standard thermodynamic potentials for eight natural zeolites with unknown properties have been calculated. The presented method does not demand any infor- mation about crystal structure of zeolites and can be applied to any of their stoichiometric presentation. Keywords: Na-Zeolites, Standard Thermodynamic Potentials, Linear Programming 1. Introduction of systems and components on the basis of dual theorems in convex programming [3]. With the use of linear pro- gramming problems for complex copper sulfates the relative mistakes of standard Gibbs potentials calculation have been obtained at about 1% [4]. We’ll consider the application of linear programming methods for an esti- mation of thermodynamic potentials for Na-zeolites. Zeolites are very important aluminosilicate microporous substances of multipurpose usage. Possessing specific framework they actively participate in processes of sorp- tio