Abstract

A method for calculating the flash point from the results of simulating liquid–solid equilibrium at constant pressure using the Gibbs equation is discussed. A model is used to predict the flash point of the mixture based on the modified Le Chatelier equation, the Antoine equation and a model for estimating the activity coefficient. The flammability hazard of liquids is primarily characterized by their flash point. The flash point is defined as the temperature at which a liquid evaporates and forms a flammable mixture with air. To measure the flash point, closed and open type devices are used. In closed-type devices, the state of equilibrium between the liquid and vapor components of the mixture is studied. Open type devices take into account the interaction of a mixture of flammable liquids with the atmosphere. The flash point of a mixture is a critical property, but experimental data for many mixtures are lacking and obtaining such data is expensive and time-consuming. Therefore, the development of mathematical models for analyzing the state of the environment under conditions of increasing risk of emergency situations is an important scientific and practical task. This paper examines the possibility of predicting the flash point in closed-type devices, i.e. the influence of atmospheric conditions is not taken into account in this approximation. Several models for predicting the flash point for mixtures of various types have been proposed previously. Keywords: binary mixtures, flash point, boiling point, activity coefficients, solvation coefficient, association coefficient.

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