Sharif Digital Repository

Regularities shown by different fluids along the contour of the ideal compressibility factor Z= PV/(RT)=1 in the temperature density plane was used to test the accuracy of the equations of state and derive temperature dependencies of their parameters. The contour, also known as the Zeno line, was empirically observed to be nearly linear. The precision of the van der Waals equation in predicting the Zeno line was evaluated. It was shown that the equation could predict a linear relation between temperature and density on the Z=1 contour, qualitatively  

In this work, a new two-parameter cubic equation of state is presented based on perturbation theory for predicting phase behavior of pure compounds and of hydrocarbons and non-hydrocarbons. The parameters of the new cubic equation of state are obtained as functions of reduced temperature and acentric factor. The average deviations of the predicted vapor pressure, liquid density and vapor volume for 40 pure compounds are 1.116, 5.696 and 3.083%, respectively. Also the enthalpy and entropy of vaporization are calculated by using the new equation of state. The average deviations of the predicted enthalpy and entropy of vaporization are 2.393 and 2.358%, respectively. The capability of the... 

A new-generation equation of state, perturbed-chain statistical association fluid theory (PC-SAFT), has attracted much attention to modeling the phase behavior of fluids using molecular-based equations of state. A set of three pure component parameters is needed for non-associative compounds, conventionally determined by fitting vapor pressure and liquid density data simultaneously. Unfortunately, experimental data are scarce, and the number of pure substances is too large. Thus, it is indispensable for developing predictive methods to determine the pure component parameters. In the present paper, a new model has been developed to estimate PC-SAFT parameters for different pure components,... 

In this paper, the Heidaryan and Jarrahian equation of state (Heidaryan and Jarrahian, 2013) has been adapted as a first worldwide cubic EOS to calculate the density of dry natural gases, wet natural gases, and single-phase gas condensates "sweet and sour mixtures" (up to 73.85, 97.63 and 38.37 mol percent of H2S, CO2, and N2 respectively) even when the gas composition is unknown, through new gas specific gravity correlation equations. Correction terms of water content as high as 10 mol percent of H2O and hythane (natural gas + hydrogen) as high as 74.9 mol percent of H2 were obtained. The equation of state was validated with 8985 experimental compressibility factor data points from 308... 

In this study, six cubic equations of state (CEoSs) were used to predict the Joule-Thomson coefficient (JTC), specific heat capacity (SHC), inversion curve (IC) and outlet temperature of the Joule-Thomson (JT) valve parameters. The accuracy of each CEoS was evaluated from the comparison of experimental data with obtained results. Of the six CEoSs, three-paramter CEoSs— Esmaeilzadeh and Roshanfekr (ER), Harmen and Knapp (HK), and Patel and Teja (PT)— were more accurate than two-paramter equations— Nasrifar and Moshfeghian (NM), Peng-Robinson (PR), and Soave-Redlich-Kwong (SRK). Ironically, original SRK showed the optimum accuracy in estimation of JTC. In addition, the Joule-Thomson inversion... 

Various models have been applied composed of the Peng-Robinson equation of state (PR-EoS) and the Soave-Redlich-Kwong equation of state (SRK-EoS) associated with three mixing rules including the following: Wong-Sandler (WS), van der Waals one (vdW1), and van der Waals two (vdW2) for phase behavior modeling of mixtures of supercritical CO2+different ionic liquids in vapor-liquid equilibrium (VLE) region. It has been found that the PR EoS implying the WS mixing rule can be used as a reliable thermodynamic model to perform a thermodynamic consistency test on the experimental data of phase behaviors of the supercritical CO2+ionic liquid systems (19 commonly-used ionic liquids have been studied).... 

New experimental results are presented for the solubility of carbon dioxide, hydrogen sulfide in the ionic liquid 1-octyl-3-methylimidazolium hexafluorophosphate ([C8mim][PF6]) at temperatures range from (303.15 to 353.15) K and pressures up to about 2 MPa. The solubility of the mixture of CO2/H2S in [C8mim][PF6] under various feed compositions were also measured at temperatures of (303.15, 323.15 and 343.15) K and the pressure up to 1 MPa. The solubility of carbon dioxide and hydrogen sulfide increased with increasing pressure and decreased with increasing temperature and the solubility of H2S is about three times that of CO2 in the particular ionic liquid studied. The measured data were... 

The objective of this work is making comparison between thermodynamic models and data-driven techniques accuracy in prediction of hydrate formation pressure as a function of temperature and composition of gas mixtures. The Peng-Robinson (PR) and Patel-Teja (PT) equations of state are used for thermodynamic modeling and Artificial Neural Networks (ANNs) and Adaptive Neuro-Fuzzy Inference System (ANFIS) are used as data-driven models. The capability of each method is evaluated by comparison with the experimental data collected from literature. It is shown that there is a good agreement between thermodynamic modeling and the experimental data in most of the cases; however, the prediction... 

A large variety of modifications have been presented for the temperature dependent function (α) existing in the attractive term of cubic equations of state (CEOS). Most of α-functions attempted to modify the vapor pressure prediction of polar components while other modifications have focused on both polar and non-polar compounds and other relations have considered an expansion of polynomials in the acentric factor (ω) and reduced temperature (Tr) to predict vapor pressure more accurately. In most cases such as Soave and Peng-Robinson equations of state, the suggested α-functions do not show a limiting behavior when temperature increases infinitely. In addition, the incompetency of many... 

In this work, PC-SAFT, an equation of state based on perturbation theory, is applied to predict the reservoir fluids phase behavior. PC-SAFT parameters for pure components have previously been assessed, but they cannot be determined for petroleum fractions with unspecified components and composition. In order to remove this difficulty and making use of PC-SAFT model in the reservoir fluids simulations, a new approach is studied which leads to appearing generalized correlations for the estimation of PC-SAFT parameters for petroleum cuts and plus fractions using only their molecular weight and specific gravity, without the essential need for the characterization of petroleum fractions in... 

In this study, the prediction of excess molar volume of ionic liquid + solvent binary system is described using modified two-parameter and three-parameter cubic equation of state (CEoS). The studied binary systems are consisted of 41 ionic liquids, 40 solvents and 5293 data point in the wide temperature range (278.15–353.15 K), ionic liquid mole fraction (0.0036–0.9920) and atmospheric pressure i.e. P = 1 bar. At the first step, the volume-translated parameter (c) was obtained based on three linear, distance function and exponential-type temperature-dependent cases and using experimental pure density. After that, and due to easy-to-use of c-parameter, various formula was presented based on...