JOURNAL OF CHEMICAL THERMODYNAMICS
·
2016
·
IF 2.196
Hengde Li,Zhangni Feng,Li Wan,Cheng Huang,Tianfei Zhang,Yanxiong Fang
As an eco-friendly compound from essential oils, 1,8-cineole (cineole, eucalyptol) has the potential to replace the ozone depleting industrial solvents. This paper presents experimental (liquid + liquid) equilibrium (LLE) data for four alcohol–water systems containing 1,8-cineole. To evaluate the phase equilibrium properties of 1,8-cineole in aqueous alcohol mixtures, LLE values for the ternary systems (water + methanol or ethanol or 1-propanol or 1-butanol + 1,8-cineole) were determined with a tie-line method at T = 298.15 K under atmospheric pressure. The well-known Hand, Bachman and Othmer–Tobias equations were used to test the reliability of the experimental results. The binodal curves and distribution ratios of alcohol in the mixtures are shown and discussed. The experimental LLE values were satisfactorily correlated by the NRTL and UNIQUAC models.
研究领域:
化学工程
·
环境科学
✓ 已验证
产品关联
DOI
高影响因子
JOURNAL OF CHEMICAL THERMODYNAMICS
·
2015
·
IF 2.679
Yujuan Chen,Kelei Zhuo,Jing Chen,Guangyue Bai
Apparent molar volumes V Φ ,DIL and viscosity B -coefficients of the dicationic ionic liquids (DILs) in {glucose (Glc) + water} solutions were determined from density and viscosity measurements at T = 298.15 K. Limiting apparent molar volumes V Φ ,DIL 0 of the DILs, volumetric interaction parameters, and activation energies Δ μ DIL 0 ≠ were also obtained, together with the contributions of the solvent property B 1 and the dicationic ionic liquid – solvent interaction B 2 to the B -coefficient. A linear relation was observed between V Φ ,DIL 0 and the number of methylene groups n (CH 2 ) in the alkyl linkage chain of DILs. Volumetric interaction parameters and B 2 values are positive and increase with increasing the length of alkyl linkage chain of the dication. The DIL – glucose interactions were discussed in terms of the size and solvation of the DILs and glucose.
✓ 已验证
DOI
高影响因子
JOURNAL OF SOLUTION CHEMISTRY
·
2013
·Vol. 42
·期 9
·1782-1793
·
IF 1.128
Lu Jia,Li Shu’ni,Zhai Quanguo,Jiang Yucheng,Hu Mancheng
The mean activity coefficients for CsCl in N -methylformamide or urea ( w ) + H 2 O (1 − w ) systems were determined in this work by potentiometry, using ion-selective electrodes at 298.15 K. The value of mass fraction w was varied between 0.00 and 0.40 in five unit-steps and the molality of CsCl was between 0.0020 and 1.4009 mol·kg −1 . The experimental data have been correlated with the Pitzer, modified Pitzer and the extended Debye–Hückel equations. The resulting values of the mean activity coefficients, the osmotic coefficients and the standard Gibbs energy of transfer, together with the Pitzer ion-interaction parameters ( β
(0) , β
(1) and C
φ ), extended Debye–Hückel parameters ( a , c and d ), and modified Pitzer parameters ( b , B
MX , C
MX ) are reported for the investigated systems.
研究领域:
化学
·
物理化学
✓ 已验证
DOI
高影响因子
JOURNAL OF CHEMICAL AND ENGINEERING DATA
·
2014
·
IF 2.045
Kelei Zhuo,Hao Ren,Yujing Wei,Yujuan Chen,Jingjing Ma
Activity coefficients of the 1-alkyl-3-methylimidazolium bromide [Cnmim]Br (n = 3 to 8) ionic liquids (ILs) in fructose + water mixed solvents at 298.15 K were determined by cell potential measurements. The molalities of [Cnmim]Br ranged from (0.005 to 0.1) mol·kg–1 and those of fructose from (0.2 to 0.8) mol·kg–1. Gibbs free energy interaction parameters were also obtained together with salt constants. The interactions between [Cnmim]Br and fructose are mainly controlled by electrostatic interactions. Gibbs free energy interaction parameters (gES) and salting constants (kS) are negative for the ILs (n = 3 to 6), indicating fructose are salted-in by the ILs in water, whereas fructose are salted-out by the ILs (n = 7 and 8).
研究领域:
化学
·
物理化学
✓ 已验证
产品关联
DOI
高影响因子
JOURNAL OF CHEMICAL AND ENGINEERING DATA
·
2010
·
IF 1.695
Xueqiao Xie,Juan Han,Yun Wang,Yongsheng Yan,Guowu Yin,Weisheng Guan
Experimental liquid−liquid equilibrium (LLE) binodal curves, tie-lines, and plait points were obtained for the PPG400 + salt (K3PO4, K2CO3, and K2HPO4) + H2O systems at T = 298.15 K. The Merchuk equation was used to correlate the binodal data of the investigated systems. Also, the effect of salt on the phase-forming ability has been studied based on the effective excluded volume (EEV) values from fitting the binodal data to the binodal model developed by Guan, and the salting-out abilities of the anions are in the order of PO43− > HPO42− > CO32−, which may be related to the Gibbs free energy of hydration of the ions (ΔhydG). Furthermore, tie-line compositions were correlated using the Setschenow-type, Othmer−Tobias, and Bancroft equations, and the parameters are reported.
研究领域:
化学
·
生物学
✓ 已验证
DOI
高影响因子
JOURNAL OF CHEMICAL THERMODYNAMICS
·
2016
·
IF 2.196
Lijiang Guo,Haijun Han,Ouyang Dong,Yan Yao
Water activities of the high concentration solid solution-aqueous solution system (SS-AS) KCl–RbCl–H 2 O and its sub-binary systems at T = 298.15 K and T = 323.15 K have been elaborately measured by an isopiestic method. The solubility of this ternary system at T = (298.15, 308.15 and 323.15) K was also measured by a Flow-Cloud-Point method. A Pitzer model was used to estimate the reliability of the solubility reported in the literature, and to judge the type of solid phase, by correlating the measured water activity and the reported solubility values. The binary model parameters as a function of temperature between T = 298.15 K and T = 323.15 K were obtained by fitting the water activities in the binary systems. The predicted water activities at T = 298.15 K and T = 323.15 K with the obtained binary parameters only, are in good agreement with the experimental values, which indicate that the Pitzer model can reliably represent the properties of the ternary system, with binary parameters only within the temperature range from T = 298.15 K to T = 323.15 K. Under the different assumptions that the equilibrium solid phase involved the pure salts (KCl (s) and RbCl (s) ) for the ideal solid solution or regular solid solution (K, Rb)Cl (ss) , the solubility isotherms at T = (298.15, 308.15 and 323.15) K were calculated and compared to experimental results, respectively. It was found that only the calculated solubility isotherms for (K, Rb)Cl (ss) regular solid solution are consistent with the corresponding experimental values. The solid phase equilibrated with the aqueous solution in the KCl–RbCl–H 2 O ternary system should be a regular solid solution (K, Rb)Cl (ss) . This conclusion also can be verified from the Lippman log ∑ K − X s − X act and Φ ∑ m − X s − X aq equilibrium diagrams.
研究领域:
物理化学
·
热力学
✓ 已验证
DOI
高影响因子
ZEITSCHRIFT FUR KRISTALLOGRAPHIE-NEW CRYSTAL STRUCTURES
·
2023
·Vol. 238
·期 6
·1069-1070
·
IF 0.3
Yan-Qing Wang,Wen-Qing Yan,Li-Xue Nie,Ping-Ping Luan,Chao-Qun Li
C 20 H 22 Cu 3 N 8 O 10 , monoclinic, C 2/ c (no. 15), a = 12.0766(11) Å, b = 16.2778(14) Å, c = 14.7605(13) Å, β = 97.8580(10) ∘ , V = 2874.4(4) Å 3 , Z = 4, R
gt ( F ) = 0.0420, wR
ref ( F
2 ) = 0.0988, T = 298.15 K.
研究领域:
无机化学
·
晶体学
✓ 已验证
DOI
高影响因子
JOURNAL OF CHEMICAL THERMODYNAMICS
·
2024
·
IF 2.2
Yufeng Tang,Qichao Yang,Zhanping Qiao
The phase equilibrium of ternary systems RbX/CsX + CuX 2 + H 2 O (X = Cl, Br) at T = 298.15 K were investigated by the isothermal dissolution equilibrium method, in which the composition of equilibrium solid phases was determined by the Schreinemaker’s wet residue method. In the system RbCl + CuCl 2 + H 2 O, there were three crystallization regions corresponding to RbCl, Rb 2 CuCl 4 ·2H 2 O and CuCl 2 ·2H 2 O, respectively. Five crystallization fields corresponding to CsCl, CsCuCl 3 , Cs 3 Cu 2 Cl 7 ·2H 2 O, Cs 2 CuCl 4 and CuCl 2 ·2H 2 O were formed in the system CsCl + CuCl 2 + H 2 O. The ternary system RbBr + CuBr 2 + H 2 O had three crystalline regions corresponding to RbBr, Rb 2 CuBr 4 ·2H 2 O and CuBr 2 . In the system CsBr + CuBr 2 + H 2 O, the solid-phases of CsCuBr 3 , Cs 2 CuBr 4 , besides CsBr and CuBr 2 , were discovered. The results were compared with available literature data for cesium bromide/copper bromide salt-water system. The seven new solid phase were characterized using the X-ray diffraction method and thermogravimetric/differential analysis. The dissolution enthalpies of Rb 2 CuCl 4 ·2H 2 O, Rb 2 CuBr 4 ·2H 2 O, CsCuCl 3 , Cs 3 Cu 2 Cl 7 ·2H 2 O, Cs 2 CuCl 4 , CsCuBr 3 and Cs 2 CuBr 4 at T = 298.15 K were measured. Their standard enthalpies of formation were obtained, and the results were in order with −(1714.4 ± 3.2) kJ·mol −1 , −(1533.6 ± 3.3) kJ·mol −1 , −(697.8 ± 3.1) kJ·mol −1 , −(2418.9 ± 6.1) kJ·mol −1 , −(1134.8 ± 3.2) kJ·mol −1 , −(563.5 ± 3.2) kJ·mol −1 and −(966.2 ± 3.3) kJ·mol −1 , respectively.
研究领域:
物理化学
·
无机化学
·
热力学
✓ 已验证
DOI
高影响因子
JOURNAL OF CHEMICAL THERMODYNAMICS
·
2020
·
IF 2.888
Zhan-Ping Qiao,Tian Yang,Shu-Zhi Cao,Yu-Feng Tang,Qi-Chao Yang
Solid-liquid equilibria in the ternary systems RbX + CdX 2 + H 2 O (X = Cl, Br) at T = 298.15 K and under 101.3 kPa were investigated by the method of isothermal solution saturation, and the corresponding phase diagrams were constructed. It was found that there were five crystallization regions corresponding to CdCl 2 ·2.5H 2 O, RbCd 2 Cl 5 ·H 2 O, RbCdCl 3 , Rb 4 CdCl 6 and RbCl in the system (RbCl + CdCl 2 + H 2 O). Four crystallization regions corresponding to CdBr 2 ·4H 2 O, RbCdBr 3 , Rb 4 CdBr 6 and RbBr were found in the system (RbBr + CdBr 2 + H 2 O). The new solid compounds RbCdCl 3 , RbCdBr 3 and Rb 4 CdBr 6 were congruently soluble in water, and new double salts RbCd 2 Cl 5 ·H 2 O and Rb 4 CdCl 6 were incongruently soluble in water. The new solid-phase compounds RbCd 2 Cl 5 ·H 2 O, RbCdCl 3 , Rb 4 CdCl 6 , RbCdBr 3 and Rb 4 CdBr 6 were characterized by chemical analysis, XRD and TG-DTG techniques. The standard molar enthalpies of solution of RbCd 2 Cl 5 ·H 2 O, RbCdCl 3 , Rb 4 CdCl 6 , RbCdBr 3 and Rb 4 CdBr 6 in water were measured to be (20.74 ± 0.16) kJ·mol −1 , (28.00 ± 0.39) kJ·mol −1 , (96.56 ± 0.50) kJ·mol −1 , (35.38 ± 0.33) kJ·mol −1 and (110.64 ± 0.62) kJ·mol −1 by microcalorimetry in the condition of infinite dilution, and their standard molar enthalpies of formation were determined to be −(1545.3 ± 0.6) kJ·mol −1 , −(856.5 ± 0.7) kJ·mol −1 , −(2180.1 ± 1.3) kJ·mol −1 , −(727.1 ± 0.7) kJ·mol −1 and −(1920.5 ± 1.3) kJ·mol −1 , respectively.
研究领域:
物理化学
·
热力学
·
材料科学
✓ 已验证
产品关联
DOI
高影响因子
JOURNAL OF CHEMICAL AND ENGINEERING DATA
·
2020
·
IF 2.369
Miyangzi Suo,Bokun Chen,Yu Qian,Siyu Yang
The synergistic effect for a solvent mixture of diisopropyl ether and n-Pentanol to extract hydroquinone from aqueous solution was investigated. Liquid–liquid equilibrium data of the quaternary (n-Pentanol + diisopropyl ether + water + hydroquinone) system were measured at T = 298.15 K and P = 101.3 kPa, using various compositions of solvent mixture. It can be seen from the slope of the tie lines that with the increase of distribution coefficients of hydroquinone, the size of the immiscible solution region decreased slightly. The extraction efficiency was evaluated by calculating the separation factor and distribution coefficient. Using the universal quasichemical (UNIQUAC) and nonrandom two-liquid (NRTL) models to correlate with experimental data, the corresponding binary interaction parameters were obtained. The RMSD values of UNIQUAC and NRTL models showed that the calculated results were in good agreement with the liquid–liquid equilibrium data.
研究领域:
化学工程
·
物理化学
·
环境科学
✓ 已验证
产品关联
DOI
高影响因子
JOURNAL OF CHEMICAL THERMODYNAMICS
·
2016
·
IF 2.196
Dandan Gao,Dongdong Li,Wu Li
Solubility of RbCl(cr) and CsCl(cr) in pure water were determined at subzero temperatures. The solubility of RbCl(cr) and CsCl(cr) decreased with temperature increment. Specific heat capacity of RbCl(aq) and CsCl(aq) solutions were determined at 298.15 K and concentration to near saturation. The specific heat capacity of RbCl(aq) and CsCl(aq) solutions decreased with concentration increment and for the same molality the specific heat capacity of CsCl(aq) is smaller than that of RbCl(aq). A temperature dependent thermodynamic model based on the Pitzer-Simonson-Clegg activity coefficient equations was used to represent the activity, thermal and solid-liquid equilibria properties of RbCl + H 2 O and CsCl + H 2 O systems. The obtained models can reproduce and predict the thermodynamic properties and phase diagram of the two binary systems well for the temperature range from 200 K to 370 K. The present models have an advantage especially at subzero temperatures due to the utilization of low temperature solubility experimental data in parameterization.
研究领域:
物理化学
·
热力学
✓ 已验证
产品关联
DOI
高影响因子
危险品化学品经营许可证（带存储）