Performance Evaluation of PρT-SAFT, PρT-PC-SAFT, PC-SAFT, and CPA Equations of State for Predicting Density, Thermal Expansion Coefficient, Isothermal Compressibility, Isobaric Heat Capacity, Speed of Sound, and Saturated Vapor Pressure of Three Pure

Abstract Ethylene glycols are a group of versatile industrial solvents with broad applications across various sectors. Accurate thermodynamic modeling of these compounds is essential for enhancing their utilization and optimizing industrial processes. Among the advanced models available, the Statistical Associating Fluid Theory (SAFT) type equation of state (EoS) stands out for its effectiveness in capturing the thermodynamic behavior of complex fluids. This study employs the PρT-SAFT, PρT-PC-SAFT, PC-SAFT, and CPA EoSs to model pure monoethylene glycol (MEG), diethylene glycol (DEG), triethylene glycol (TEG), and their mixtures. Furthermore, the predictive capabilities of these models are critically evaluated for polyethylene glycol 400 (PEG 400). The performance of the PρT-SAFT, PρT-PC-SAFT, PC-SAFT, and CPA EoSs was evaluated for predicting key thermodynamic properties, including density, thermal expansion coefficient, isothermal compressibility, isobaric heat capacity, speed of sound, and saturated vapor pressure, for pure MEG, DEG, TEG, and PEG 400. Among the models, the PρT-SAFT demonstrated superior accuracy in modeling their properties. Subsequently, the volumetric properties and vapor–liquid equilibrium data of binary mixtures of MEG, DEG, and TEG were predicted using the same EoSs, without incorporating any binary interaction parameters. Under these conditions, the PρT-SAFT achieved the highest accuracy. Furthermore, predictions of the volumetric properties for the ternary mixture of MEG, DEG, and TEG also indicated that the PρT-SAFT outperformed the other models. The overall average absolute deviation percentages for the PρT-SAFT, PρT-PC-SAFT, PC-SAFT, and CPA EoSs across all examined thermodynamic properties and systems were 7.0, 8.2, 22.2, and 30.2, respectively, confirming the robustness of the PρT-SAFT.