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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2022 · IF 3.119

Measurements of Solid–Liquid Equilibria in the Quaternary Systems LiBr–NaBr–KBr–H2O and LiBr–KBr–SrBr2–H2O at 308.15 K

Xiao-Feng Guo,Shi-Hua Sang,Chao Ye

The underground brines in the Sichuan basin of China are rich in many valuable components, such as Li+, K+, Sr2+, Br–, and others. In view of comprehensive utilization of the underground brines, the stable solid–liquid equilibria of the quaternary systems LiBr–NaBr–KBr–H2O and LiBr–KBr–SrBr2–H2O at 308.15 K were measured by the isothermal dissolution equilibrium method. The results show that both phase diagrams of the quaternary systems listed above are hydrate-type. Both equilibrium phase diagrams are composed of two invariant points, five univariant curves and four crystallization fields. The equilibrium solid phases in the first quaternary system are LiBr·2H2O, NaBr·2H2O, NaBr, and KBr, respectively, and those in the second quaternary system are LiBr·2H2O, SrBr2·6H2O, SrBr2·2H2O, and KBr. In both phase diagrams, the crystallization field of KBr is the largest, while that of LiBr·2H2O is the smallest. The results indicate that KBr is the easiest to be separated from the saturated solution in the two quaternary systems. Furthermore, the comparison of phase equilibria of the quaternary systems and its ternary subsystems at different temperatures is presented and discussed in detail.

CAS / MDL: 7550-35-8 7789-53-9
研究领域: 化学工程 · 物理化学 · 材料科学
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Processes · 2022 ·Vol. 10 ·期 5 ·823 · IF 3.352

Phase Equilibrium of the Quaternary System LiBr-Li2SO4-KBr-K2SO4-H2O at 308.15 K

Bin Li,Xinjun Jing,Junsheng Yuan

The phase equilibria of the reciprocal quaternary system LiBr-Li2SO4-KBr-K2SO4-H2O and its ternary sub-systems LiBr-Li2SO4-H2O and KBr-K2SO4-H2O at 308.15 K were studied using the isothermal dissolution equilibrium method. Then, the solubility data of the equilibrium solutions were collected, and the phase diagrams were plotted. The phase diagrams of the ternary sub-systems at 308.15 K were compared with those at other temperatures. This study found that the phase diagram of the LiBr-Li2SO4-H2O system at 308.15 K consisted of an invariant point, two solid-phase crystallization regions of Li2SO4·H2O and LiBr·2H2O, and their corresponding solubility curves. The system generated two hydrated salts, which belonged to the hydrate type I phase diagram. The phase diagram of the KBr-K2SO4-H2O system at 308.15 K consisted of an invariant point, two univariant solubility curves, and two solid-phase crystallization regions of KBr and K2SO4, and no solid solution and double salts were formed. Thus, it belonged to a simple co-saturation type phase diagram. In the LiBr-Li2SO4-KBr-K2SO4-H2O system, K2SO4·Li2SO4double salt formed at 308.15 K, and the phase diagram consisted of three invariant points, five crystallization regions, and seven univariant solubility curves.Keywords:lithium bromide;potassium bromide;lithium sulfate;potassium sulfate;phase equilibrium

研究领域: 化学 · 材料科学
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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2026 · IF 2.4

Water Activity Measurement and Thermodynamic Modeling for the System Na2CO3–Cs2CO3–H2O at 308.15 K

Jia Xu,Xun Wang,Tongqing Wang,Ziwei Hu,Ruyi Lin,Dan Li,Yong Ma,Lingzong Meng,Yafei Guo,Guangli Zhou,Tianlong Deng

The isopiestic equilibria in the system Na2CO3–Cs2CO3–H2O at 308.15 K were investigated with an improved isopiestic method with a modified gravimetric isopiestic apparatus. The water activities and osmotic coefficients were determined based on the calcium chloride standard reference solution. The equilibrium vapor pressure was calculated with the water activity. Combining the Pitzer binary parameters of Na2CO3, the Pitzer binary parameters β(0), β(1), and Cφ of Cs2CO3 and Pitzer mixing parameters θNa+, Cs+ and ψNa+, Cs+, CO32– were fitted with the experimental osmotic coefficients on the basis of the Pitzer model. The water activities were then calculated by the Pitzer parameters, and the good agreement between the calculated water activities and experimental results of this ternary system indicated that the Pitzer parameters obtained in this work were reliable. The thermodynamic data and Pitzer parameters obtained in this work can provide fundamental thermodynamic data for development of universal chemical models for brine systems containing cesium carbonate.

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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2026 · IF 2.4

Solid–Liquid Phase Equilibria in the Quaternary System Na+, Cs+//Cl–, CO32––H2O at 308.15 K

Jia Xu,Xun Wang,Jiazheng Qin,Ziwei Hu,Ruyi Lin,Yong Ma,Dan Li,Lingzong Meng

The solid–liquid phase equilibria of the quaternary system Na+, Cs+//Cl–, CO32––H2O and its subsystem Na2CO3–Cs2CO3–H2O at 308.15 K were studied by the isothermal dissolution method. The phase diagram of the system Na2CO3–Cs2CO3–H2O is composed of two single-salt crystallization fields of Na2CO3·H2O and Cs2CO3·H2O, two solubility univariant curves, and one invariant point. The dry-salt phase diagram of the quaternary system consists of three invariant points, seven univariant curves, and five crystallization regions corresponding to Na2CO3·H2O, NaCl, solid solution [Cs1–x(Na·H2O)x]Cl, Cs2CO3·H2O, and double salt CsCl·2NaCl·2H2O. The areas of crystallization zones decrease according to the above order. The Jan̈ecke index of H2O, pH, and refractive index of the liquid phase in the quaternary system change regularly with the Jan̈ecke index of Cs+. These results on the phase diagram of the quaternary system can supply theoretical references for cesium salt separation from carbonate-type brine.

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JOURNAL OF CHEMICAL THERMODYNAMICS · 2026 · IF 2.5

Mutual diffusion coefficient of two alcohols (ethanol, n-butanol) in n-hexane from 298.15 K to 308.15 K

Kaijian Li,Yuqi Su,Maogang He,Ying Zhang

Reliable diffusion data for alcohol–alkane mixtures are still limited, particularly for systems exhibiting strong non-ideal behavior. In this work, mutual diffusion coefficients for ethanol + n-hexane and n-butanol + n-hexane were measured over the entire composition range at 298.15–308.15 K using digital holographic interferometry. The relative standard uncertainty associated with the optical measurement subsystem was estimated to be 0.0118. After propagation of the identified instrumental uncertainty sources, including temperature control, phase-parameter determination, composition preparation, and material purity, the instrumental relative standard uncertainty of the diffusion coefficients was evaluated to be 0.0121, corresponding to an expanded uncertainty of approximately 2.42% (k = 2). Considering the additional variability among independent experimental realizations, the overall expanded relative uncertainty was estimated to be approximately 4.8% (k = 2). For both systems, the mutual diffusion coefficient shows a pronounced U-shaped dependence on composition, with a minimum at intermediate alcohol mass fractions. In the limit of ω 1  → 0, the mutual diffusion coefficient approaches the tracer diffusion coefficient of alcohol in n-hexane, corresponding to diffusion under infinite dilution conditions. The observed behavior reflects strong non-ideal interactions, primarily associated with hydrogen bonding and composition-dependent molecular interactions. Compared with ethanol, the n-butanol + n-hexane system exhibits stronger non-ideality, consistent with the longer alkyl chain of n-butanol. The experimental data were evaluated using the Darken, Vignes, and UNIDIF models. Among them, the UNIDIF model provided the best overall agreement, although deviations remain significant over the full composition range. For ethanol + n-hexane at 298.15 K, the present results show good agreement with available literature data in terms of the overall composition-dependent trend, supporting the reliability of the measurement methodology. The new diffusion data reported here extend the available database for alcohol–alkane systems and provide a consistent basis for improving transport modeling.

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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2021 · IF 2.694

Solid–Liquid Phase Equilibria of the Ternary System (KBO2 + K2SO4 + H2O) at 288.15, 308.15 K, and 0.1 MPa

Fei Yuan,Hua Li,Long Li,Yafei Guo,Shiqiang Wang,Tianlong Deng

Considering the significance of fundamental phase equilibrium data in resource exploitation from salt lake brines, the solid–liquid phase equilibria of the ternary system (KBO2 + K2SO4 + H2O) at 288.15, 308.15 K, and 0.1 MPa were investigated using the isothermal dissolution method. Along this line, the solubilities and physicochemical properties of densities were experimentally determined. Based on the experimental data, phase diagrams and the related physicochemical property diagrams against composition were plotted. It was found that there are one invariant point, two univariate solubility curves, and two crystalline regions corresponding to potassium metaborate hydrate (KBO2·1.33H2O) and arcanite (K2SO4) in the ternary phase diagrams at 288.15 and 308.15 K. In addition, they belong to the hydrate type I and neither double salt nor solid solution was formed. The distributive behaviors of density against the concentration of KBO2 in the equilibrium solution at two temperatures were similar. Moreover, the theoretical values of density were calculated, which were found to be consistent with the experimental values, further demonstrating the accuracy and reliability of this work.

CAS / MDL: 1310-58-3 7778-80-5
研究领域: 化学 · 物理化学
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THERMOCHIMICA ACTA · 2023 · IF 3.5

Dilution enthalpies of the binary systems (LiBO2 + H2O) and (LiB5O8 + H2O) and the ion interactions at 308.15 K

Yuqi Wang,Linxue Yan,Hua Li,Long Li,Yafei Guo,Tianlong Deng

Microcalorimeter measured the dilution enthalpies of the binary systems (LiBO 2  + H 2 O) and (LiB 5 O 8  + H 2 O) at 308.15 K and 0.1 MPa. Based on the Pitzer theory of electrolytes, their apparent molar enthalpies and the Pitzer single electrolyte parameters at 308.15 K were carried out by fitting the experimental data for the first time. Moreover, the calculated apparent molar enthalpies of LiBO 2 and LiB 5 O 8 aqueous solution according to the Pitzer ion-interaction model were consistent well with the experimental values, manifesting the high reliability of this study.

研究领域: 物理化学 · 热力学
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JOURNAL OF CHEMICAL THERMODYNAMICS · 2016 · IF 2.196

Stable (solid + liquid) phase equilibrium for the ternary system (NaCl + RbCl + H2O) at T = (288.15, 298.15 and 308.15) K

Yunxue Gao,Shuni Li,Quanguo Zhai,Yucheng Jiang,Mancheng Hu

The (solid   +   liquid) phase equilibrium of the ternary system (NaCl   +   RbCl   +   H 2 O) at T   =   (288.15, 298.15 and 308.15)   K was studied by the method of isothermal solution saturation. Moreover, the density and refractive index of the solution was also determined. The solid phase was studied by the Schreinemaker’s wet residue method and verified by X-ray diffraction. The results show that each of the phase diagrams contains one invariant point, two univariant curves, and three crystallization regions. The crystallization region of NaCl increased obviously with the temperature increasing, while the crystallization regions of RbCl and the mixed crystallization region of (NaCl   +   RbCl) decreased a little. Furthermore, there are break points at the invariant points for density and refractive index curves.

CAS / MDL: 143-66-8
研究领域: 化学 · 材料科学
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FLUID PHASE EQUILIBRIA · 2015 · IF 2.2

Liquid–liquid phase equilibrium for ternary mixtures of formamide (or ethylene glycol, or monoethanolamine) + indole + 2-methylnaphthalene at 308.15 K

Yang Feng,Entao Yang,Leping Dang,Hongyuan Wei

Liquid–liquid phase equilibrium data for ternary systems containing formamide (or ethylene glycol (EG), monoethanolamine (MEA)   +   indole   +   2-methylnaphthalene (2-MN) at 308.15   K under atmospheric pressure were measured in this work. The results show that all the three ternary systems are Treyball type 1 systems. The experimental data were correlated well using both the non-random two liquid (NRTL) model and universal quasi-chemical activity coefficient (UNIQUAC) model. In addition, both the distribution coefficient and selectivity coefficient of formamide, EG and MEA were calculated to investigate the feasibility of extracting indole from 2-MN and formamide presented a better selectivity.

研究领域: 化学工程 · 物理化学
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JOURNAL OF CHEMICAL THERMODYNAMICS · 2023 · IF 2.6

Mutual diffusion coefficients of three alkanes (n-heptane, n-octane and isooctane) in cyclohexane from 288.15 K to 308.15 K

Weijie Jia,Yuqi Su,Songtao Cao,Ao Dong,Ying Zhang,Maogang He

Mutual diffusion coefficients of three alkanes (n-heptane, n-octane and isooctane) in cyclohexane were measured by digital holographic interferometry under atmospheric pressure. The measured temperature points were 288.15 K, 298.15 K and 308.15 K, respectively and the mass fraction of the measured solution range was from 0.05 to 0.95. The extended relative uncertainty of the measurement system was estimated to be less than 2.4%. The dependence of mutual diffusion coefficient on temperature and solution concentration was studied. The mutual diffusion coefficients of these three binary mixtures increase with the increase of temperature and have a nearly linear relationship with the solution concentration. And the image processing process of holographic interference image is introduced in detail. Zhang et al .’s model, Darken model and Vignes model were used to predict the mutual diffusion coefficients of the three binary mixtures, the absolute average of relative deviations (AARDs) are 2.97%, 3.89% and 6.18%, respectively and Zhang et al .’s model is the one with the best agreement among the three models.

研究领域: 化学工程 · 物理化学 · 热力学
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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2018 · IF 2.196

Solid–Liquid Phase Equilibria of the Ternary System (2-Naphthaldehyde + 4-Methylphthalic Anhydride + Ethyl Acetate) at (288.15, 298.15, and 308.15) K

Xiaoqiang Gao,Fang Zhang,Yi Yu,Yonghui Dou,Li Xu,Guoji Liu

The solubility of 2-naphthaldehyde (2-NA) and 4-methylphthalic anhydride (4-MA) in ethyl acetate at temperatures from 283.15 to 313.15 K and solid–liquid equilibrium of ternary (2-NA + 4-MA + ethyl acetate) system at temperatures of (288.15, 298.15, and 308.15) K were measured under pressure of 101.3 kPa. Three isothermal phase diagrams were plotted according to the ternary solubility data. For the ternary system, two pure 2-NA and 4-MA solids were formed at each temperature and determined by the wet residue method of Schreinemaker. The crystalline region of 2-NA decreases with the increase in temperature, and 4-MA is just the opposite. The crystallization region of 2-NA was found to be smaller than that of 4-MA. The solubility data of the system were correlated and calculated by NRTL and Wilson models. The results show that the NRTL model agrees well with the experimental data compared with the Wilson model. Furthermore, the densities of equilibrium solutions were determined at the corresponding temperatures.

CAS / MDL: 7631-99-4
研究领域: 化学工程 · 物理化学
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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2016 · IF 1.835

Volumetric Properties and Viscosity B-Coefficients for the Ternary Systems Epigallocatechin Gallate + MCl + H2O (M = Li, Na, K) at Temperatures 288.15–308.15 K

Dawei Li,Guangqian Li,Pingfeng Bian,Zhe Shen,Mengfan Fu,Wenjun Fang,Weidong Yan

Epigallocatechin gallate (EGCG) is the most abundant and active components in tea. In this text, the density and viscosity of ternary aqueous solution of EGCG containing LiCl/NaCl/KCl were determined at temperatures ranging from 288.15 to 308.15 K at atmospheric pressure. The density data was used to compute the apparent molar volumes (Vφ), limiting partial molar volumes (Vφ0), and transfer partial molar volumes (ΔtrsVφ0). The viscosity B-Coefficients were calculated from the measured viscosity data using the extended Jones–Dole equation. The values of density and viscosity increased continuously with the increasing of molality of EGCG and decreased with the temperature increasing. The positive values including (Vφ, Vφ0, ΔtrsVφ0, viscosity B-Coefficients, the free energies of activation for solvent Δμ10≠, and for solute Δμ20≠) and Helper’s constant (∂2Vφ0/∂T2)p close to zero indicated the presence of strong solute–solvent interactions and the structure–making effect of EGCG in the investigated solutions. The apparent molar isobaric expansions (Eφ0) decreasing with temperature suggested that the solute–solvent interactions became weaker as temperature increased. These significant parameters could provide necessary data about molecular interactions occurring in simulated body fluids.

CAS / MDL: 7447-41-8
研究领域: 化学 · 生物化学
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