An Implementation of the Steepest Descent Method to Evaluation of Equilibrium Composition of Reactive Mixtures Containing Components in Condensed Phases

• Autorzy: Papliński A.
• Języki publikacji: EN

Abstrakty

EN

Thermodynamic evaluation of equilibrium state of the reacting mixture is considered. The principle of minimization of the Gibbs free energy is adopted for determining of the final chemical composition and thermodynamic state of the mixture. The steepest descent method is employed to evaluate the distribution of individual species concentrations of considered chemical system. A particular attention is paid to the cases in which substances in solid or liquid phase are present in the reactive medium. A method of reduction of the number of equations in the primary set of equations is described. Accuracy of calculations performed with the presented method is discussed.

Słowa kluczowe

EN

Gibbs free energy; chemical equilibrium; steepest descent method

• Czasopismo: Central European Journal of Energetic Materials
• Rocznik: 2007
• Tom: Vol. 4, nr 1-2
• Strony: 135--150
• Opis fizyczny: Bibliogr. 14 poz.

Twórcy

autor

Papliński A.

• Institute of Industrial Organic Chemistry, 03-326 Warsaw, 6 Annopol St., Poland,

Bibliografia

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