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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2010 · IF 1.695

Vapor Pressure Measurement of the Ternary Systems H2O + LiBr + [Dmim]Cl, H2O + LiBr + [Dmim]BF4, H2O + LiCl + [Dmim]Cl, and H2O + LiCl + [Dmim]BF4

Li Jing,Zheng Danxing,Fan Lihua,Wu Xianghong,Dong Li

The aim of this work is to investigate improving the effects for adding ionic liquids (ILs) to the working fluids of absorption cycle, lithium bromide aqueous solution (H2O + LiBr), and lithium chloride aqueous solution (H2O + LiCl). 1,3-Dimethylimidazolium chloride ([Dmim]Cl) and 1,3-dimethylimidazolium tetrafluoroborate ([Dmim]BF4) were selected to be additives. The vapor pressure data were measured for the H2O + LiBr + [Dmim]Cl system (LiBr/[Dmim]Cl mass ratio = 3), H2O + LiBr + [Dmim]BF4 system (LiBr/[Dmim]BF4 mass ratio = 2), H2O + LiCl + [Dmim]Cl system (LiCl/[Dmim]Cl mass ratio = 2), and H2O + LiCl + [Dmim]BF4 system (LiCl/[Dmim]BF4 mass ratio = 2) by means of the boiling point method, at temperatures from (303.60 to 439.42) K and the mass fraction of absorbent species from 0.20 to 0.70, respectively. The Antoine-type equation was used to correlate the experimental data of the ternary systems, and the agreements with the experimental data were excellent; that is, the average absolute relative deviations (ARDs) for pressure between experimental and calculated values were 1.05 %, 0.75 %, 0.63 %, and 0.92 % for the systems. Compared with traditional working fluids of absorption cycle, H2O + LiBr and H2O + LiCl, the promising results show that four ternary systems investigated in this work might be used as alternative working fluids to improve the performances of absorption cycles and liquid desiccant dehumidification systems.

研究领域: 热力学 · 制冷与空调 · 化学工程 · 离子液体应用
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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2025 · IF 2.1

A Study on the Equilibrium System of CdBr2–l-Proline (trans-4-OH-l-Proline)–H2O at 298.15 K and the Standard Molar Enthalpies of Formation of Their Double Salts

Dong-qin Bi,Shu-han Li,Xue-jia Zhang,Zi-xiao Zhao,Qi-chao Yang,Zhan-ping Qiao

Two-phase equilibrium of ternary systems of CdBr2–l-proline/(4-OH-l-proline)–H2O at T = 298.15 K is studied. Their isothermal solution equilibrium phase diagrams have been drawn based on the solubility data. Two double salts (Cd(C5H9NO2)Br2·H2O and Cd(C5H9NO3)Br2) have been found by the Schrienemakers method in phase diagrams, and they are all congruently soluble in water. Both of them have been synthesized and characterized by powder XRD and TG-DTG. For the first time, enthalpies of solution of Cd(C5H9NO2)Br2·H2O and Cd(C5H9NO3)Br2 are measured in water, and their standard molar enthalpies of formation at 298.15 K are calculated by designing thermochemical cycles according to the Hess law. By comparison, it is found that the region of infinite dissolution appears in the ternary system of CdBr2–l-proline–H2O at 298.15 K. If the composition of the solution is in this region, there is no crystal when the water evaporates and only a viscous mixture can be obtained.

CAS / MDL: 7789-42-6
研究领域: 物理化学 · 无机化学 · 热力学 · 材料科学 · 晶体学
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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2023 · IF 2.6

Study on Vapor–Liquid Equilibrium and Microscopic Properties of Glycine + H2O, l-Histidine + H2O, and l-Tryptophan + H2O

Xia Li,Weiping Liu,Yahui Yin,Yu Zhou,Hongfei Xiang,Xianzhen Xu

Vapor–liquid equilibrium (VLE) is essential for separation processes, such as distillation and absorption in chemical production. In this work, the VLE of glycine, l-histidine, and l-tryptophan aqueous solutions was measured at pressures ranging from 5.3 to 101.1 kPa. Xu’s model was used, and the model was based on the nonrandom two-liquid (NRTL) model, which has been successfully correlated with VLE data at temperatures between 298.15 and 373.85 K, and the model parameters were obtained. In addition, the absorption peaks of three amino acid aqueous solutions were analyzed by Fourier transform infrared (FTIR) spectroscopy from a microscopic perspective. The results showed that the higher the solubility of amino acids in water, the stronger the hydrogen-bonding interaction with water. Furthermore, the total mean interaction energy of water in the systems was studied by using a COSMOthermX 2021 tool. As inferred from the calculations, the total mean interaction energy was slightly affected by the concentration. The structure–activity relationship was established between the microscopic interactions and the macroscopic VLE.

CAS / MDL: 71-00-1
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JOURNAL OF CHEMICAL THERMODYNAMICS · 2021 · IF 3.178

Experimental and modelling of vapour–liquid equilibria of ternary systems {HCOOK + [Emim]Ac + H2O}, {HCOOK + [Emim]Br + H2O}, {HCOOK + [Emim]Cl + H2O}, and {HCOOK + [Emim]NO3 + H2O}

Yaqi Ding,Neng Gao,Nian Li,Guangming Chen,Yongmei Xuan

The vapour-liquid equilibrium (VLE) data of four ternary solutions HCOOK + [Emim]Ac /[Emim]Br / [Emim]Cl / [Emim]NO 3  + H 2 O were measured using the boiling method at the temperatures from 305.78 K to 387.08 K, at solute (HCOOK + IL) mass fractions ( w ) between 0.2 and 0.5. A total of 234 data points ( w  = 0 included) were obtained and correlated with empirical Antoine-type equations. The absolute average relative deviations (AARD %) between calculated and measured vapour pressures were 0.58%, 0.50%, 0.49%, 0.63%, respectively, which showed good agreement. The comparison of the experimental and standard data and combined uncertainties of the experimental data confirmed good reliability of the experimental method and apparatus. The four ternary solutions with ILs as additives have lower vapour pressure compared to the corresponding binary solutions without ILs. The results showed that the four ternary solutions of HCOOK + [Emim]Ac / [Emim]Br / [Emim]Cl / [Emim]NO 3  + H 2 O can be the alternatives for traditional dehumidification and absorption media. [Emim]Cl has the best ability to reduce the vapour pressure of HCOOK + H 2 O at the solute (HCOOK + IL) mass fraction of 0.4 and 0.5. The [Emim]Ac has the most effect reducing the vapour pressure of HCOOK + H 2 O at the solute (HCOOK + IL) mass fraction of 0.3.

CAS / MDL: 7647-14-5
研究领域: 化学工程 · 热力学
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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2019 · IF 2.298

Vapor Pressure Measurement of Ternary Systems LiCl + [Emim]Cl + H2O, LiBr + [Emim]Cl + H2O, and LiCl + [Emim]Br + H2O

Yongmei Xuan,Xianyu Ding,Neng Gao,Yaqi Ding,Xin Meng,Guangming Chen

1-Ethyl-3-methylimidazolium chlorine ([Emim]Cl) and 1-ethyl-3-methylimidazolium bromide ([Emim]Br) as an additive to working fluid [lithium bromide aqueous solution (H2O/LiBr) and lithium chloride aqueous solution (H2O/LiCl)] of absorption cycles were proposed. The vapor pressure of H2O + LiCl + [Emim]Cl (mass ratio LiCl/[Emim]Cl = 2) in the temperature from 314.79 to 435.48 K, H2O + LiCl + [Emim]Br (mass ratio LiCl/[Emim]Br = 2) in the temperature from 317.62 to 431.27 K, and H2O + LiBr + [Emim]Cl (mass ratio LiBr/[Emim]Cl = 2) in the temperature from 303.10 to 409.91 K was measured by the boiling point method. The mass fractions of the absorbent were from 0.30 to 0.60. The experimental data were regressed using the Antoine-type equation, and the average absolute relative deviation (AARD %) between the experimental data and calculated values of three systems was 0.44, 0.51, and 0.54%. Compared with that of the previously reported ionic liquids, ([Emim]Ac) as an absorbent for LiBr + H2O, vapor pressure of these four systems follows the order LiCl + [Emim]Cl + H2O < LiCl + [Emim]Br + H2O < LiBr + [Emim]Cl + H2O < LiBr + [Emim]Ac + H2O. The proposed ternary systems have better water affinity and can be promising alternative working fluids in the absorption cooling system.

研究领域: 化学工程 · 热力学
✓ 已验证 DOI 高影响因子
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APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING · 2018 ·Vol. 125 ·期 1 ·1-9 · IF 1.604

Novel photocatalyst nitrogen-doped simonkolleite Zn5(OH)8Cl2·H2O with vis-up-conversion photoluminescence and effective visible-light photocatalysis

He Junfeng,Hu Jiamin,Mo Xi,Hao Qing,Fan Zhili,He Guannan,Wang Yinzhen,Li Wei,He Qinyu

As photocatalysts exhibit selectivity toward various pollutants, it is necessary to develop different and novel photocatalysts. In this work, a novel photocatalyst-nitrogen-doped simonkolleite Zn 5 (OH) 8 Cl 2 ·H 2 O (DSM) is prepared through a new facile method: calcinating the mixture of zinc hydroxide, urea, and guanidine hydrochloride at 575 °C for 1 h in a furnace with an air atmosphere. The as-prepared sample was characterized by X-ray diffraction (XRD), scanning electron microscopy (SEM), X-ray photoelectron spectroscopy (XPS), photoluminescence (PL) spectra, UV–visble near-infrared diffuse reflection spectra (UV–Vis–NIR DRS), Brunauer–Emmett–Teller (BET) method, Ramen spectra and Zeta potential measurement, photocatalytic properties, as well as active species trapping experiments. XRD and XPS show the as-prepared powder is nitrogen-doped simonkolleite Zn 5 (OH) 8 Cl 2 H 2 O (DSM) with a small ZnCl 2 fraction. SEM investigation indicates that the as-prepared powder possesses a flower-like layered shape. The UV–Vis–NIR exhibits that after doping, the DSM possesses strong light absorption in the ranges of 300–500 and 1400–2500 nm, a direct electronic transition with a band gap energy of 2.469 eV. PL measurement reveals a strong photoluminescence and an up-conversion from lower to higher-energy visible light in as-prepared samples. Zeta potential investigations show that during photocatalysis, the charges on as-prepared photocatalyst are positive. The photocatalytic experiments show a good dark adsorption, a high photodegradation (99.4% at 60 min), a high pseudo-first-order constant ( k ) of 0.0261 min −1 . Meanwhile, the active species trapping experiments suggest that hole (h + ) is the dominant active species during photocatalysis. It is concluded that the doping favors in enhancing vis-light-photocatalysis. This work makes a significant contribution to the literature.

CAS / MDL: 50-01-1
研究领域: 材料科学 · 化学 · 环境科学 · 催化
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JOURNAL OF ALLOYS AND COMPOUNDS · 2023 · IF 6.2

Y(HSeO3)(SeO3)(H2O)·(H2O) and Y2(SeO3)2(SeO4)(H2O)2·(H2O)0.75: Two yttrium selenites with a short UV cut-off edge explored from pure selenite compounds

Peng-Fei Li,Chun-Li Hu,Bing-Xuan Li,Fang Kong,Jiang-Gao Mao

Two UV inorganic yttrium selenite optical materials, namely, Y(HSeO 3 )(SeO 3 )(H 2 O)·(H 2 O) (1) and Y 2 (SeO 3 ) 2 (SeO 4 )(H 2 O) 2 ·(H 2 O) 0.75 (2), have been synthesized successfully by hydrothermal reactions . Of these, Y 2 (SeO 3 ) 2 (SeO 4 )(H 2 O) 2 ·(H 2 O) 0.75 (2) is a new mixed valent selenium oxide containing Se(IV) and Se(VI) cations simultaneously. Y(HSeO 3 )(SeO 3 )(H 2 O)·(H 2 O) (1) shows a 3D structure composed of 2D yttrium selenite layers linked by O−H···O bonds. Y 2 (SeO 3 ) 2 (SeO 4 )(H 2 O) 2 ·(H 2 O) 0.75 (2) exhibits a 3D structure composed of 2D yttrium selenite layers connected by SeO 4 tetrahedron. Y(HSeO 3 )(SeO 3 )(H 2 O)·(H 2 O) (1) crystallized in a chiral space group P 2 1 2 1 2 1 and could display a moderate SHG intensity about 0.7 times of the commercial KH 2 PO 4 (KDP). Its powder laser damage threshold quantity was estimated to be 120.2 MW/cm 2 , which is about 46.2 times that of AGS (2.6 MW/cm 2 ). UV–vis–NIR spectra reflectance spectra showed that these solids are wide band gap compounds with Eg of 5.5 and 5.1 eV respectively. Theoretical calculations disclosed that Y(HSeO 3 )(SeO 3 )(H 2 O)·(H 2 O) (1) is an indirect band gap structures and its bandgaps is determined by O and Se atoms.

CAS / MDL: 1314-36-9
研究领域: 无机化学 · 材料科学
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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2017 · IF 2.323

Solid–Liquid Phase Equilibria of (Ca(H2PO2)2 + H2O), (Ca(H2PO2)2 + CaCl2 + H2O), and (Ca(H2PO2)2 + NaH2PO2 + H2O) Systems

Jian-nan Yin,Xin-ying Shi,Huan Zhou,Jing-jing Tang,Ya-ping Dai,Xiao-qin Bai

Fine calcium hypophosphite can be synthesized by sodium hypophosphite and calcium chloride via the replacement reaction, and sodium hypophosphite can be synthesized from phosphorus via the intermediate of Ca(H2PO2)2. Both processes involve the interactive quaternary system of (Ca2+ + Na+)//(Cl– + (H2PO2)− + H2O) and its subsystems. In this study, the (solid + liquid) phase diagrams of the (Ca(H2PO2)2 + H2O) binary system from freezing to boiling point at normal pressure, and (Ca(H2PO2)2 + CaCl2 + H2O), (Ca(H2PO2)2 + NaH2PO2 + H2O) ternary systems at 273.15 K were experimentally determined via the classical isothermal solubility equilibrium method. It was found that (1) one anhydrous salt of Ca(H2PO2)2 occurs in (Ca(H2PO2)2 + H2O) binary systems with temperatures ranging from freezing to boiling points, (2) two solid salts of Ca(H2PO2)2 and CaCl2·6H2O exist in the (Ca(H2PO2)2 + CaCl2 + H2O) system, and (3) Ca(H2PO2)2, NaH2PO2·H2O and one incompatible double salt of NaCa(H2PO2)3 exist in the (Ca(H2PO2)2 + NaH2PO2 + H2O) system, and NaCa(H2PO2)3 has very low solubility and occupies a large solid field in the ternary system.

研究领域: 无机化学 · 化学热力学 · 相平衡 · 材料合成
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JOURNAL OF CHEMICAL AND ENGINEERING DATA · 2012 · IF 1.693

Thermal Conductivity and Density of (NH4)2SO4 + H2O, NH4NO3 + H2O, and (NH4)2SO4 + NH4NO3 + H2O Solutions at T = (278.15 to 333.15) K

Yuan-Yuan Che,Jian Shen,Jun-Chao Zhou,Chao-Hong He

The thermal conductivity of ammonium sulfate + water, ammonium nitrate + water, and ammonium sulfate + ammonium nitrate + water is of great significance in the national defense industry and military engineering for manufacturing of various energetic chemicals. The measurements, covering a temperature range from (278.15 to 333.15) K, have been performed by a transient hot-wire technique over a wide range of concentrations. The densities of ternary aqueous solutions of ammonium sulfate + ammonium nitrate are also presented at the same temperature covering different portions of ammonium sulfate and ammonium nitrate. The thermal conductivities of binary aqueous solutions of ammonium salts are correlated by polynomial functions in terms of temperature and weight fraction for the purpose of interpolation. The Aseyev equation in terms of weight fraction is also used to represent the thermal conductivities of ternary mixtures of these compounds. The ideal mixing rule of Young has been successfully applied to correlate the ternary densities of aqueous ammonium sulfate + ammonium nitrate solutions based on relevant binary solution properties. The agreement between the correlation and the experimental data is pretty good.

研究领域: 化学工程 · 材料科学
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JOURNAL OF CHEMICAL THERMODYNAMICS · 2018 · IF 2.631

Experimental and thermodynamic modeling study of the solid-liquid equilibrium in the ternary system (NaCl + NaClO3 + H2O) at 293.15 and 333.15 K and 0.1 MPa

Wanjing Cui,Xuebing Fan,Ying Liao,Xiaoping Yu,Yafei Guo,LingZong Meng,Tianlong Deng

The study of the solid-liquid phase equilibrium for (NaCl + NaClO 3  + H 2 O) system is of significance to understand the thermodynamic property of the aqueous solution of ionic membrane electrolysis process to promote the production of sodium hydroxide (caustic soda). The solubilities and the physicochemical properties including density, refractive index and pH for this ternary system at 293.15 and 333.15 K and 0.1 MPa were measured using the isothermal dissolution method. Based on Pitzer ion-interaction model and its extended HW model, the solubility equilibrium constants K sp of NaClO 3 and the mixing ion-interaction parameters ( θ Cl,ClO3 , Ψ Na, Cl,ClO3 ) at 293.15 and 333.15 K were parameterized in this work. The Debye-Hückel limiting slope A ø , the Pitzer single-salt parameters of NaCl and NaClO 3 and the solubility equilibrium constants K sp of NaCl at 293.15 and 333.15 K were taken from the relative temperature-dependence formula in the literature. A comparison shows that the calculated solubilities of the ternary system at 293.15 and 333.15 K agree well with the experimental data. The calculated results of densities and refractive indices using the empirical equations agree well with the experimental data at 293.15 and 333.15 K.

研究领域: 化学工程 · 物理化学
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CHINESE JOURNAL OF CHEMICAL ENGINEERING · 2020 · IF 2.627

Solubility measurement and prediction of phase equilibria in the quaternary system LiCl + NaCl + KCl + H2O and ternary subsystem LiCl + NaCl + H2O at 288.15 K

Ruizhi Cui

Using isothermal dissolution method, the phase equilibrium relationship in quaternary system LiCl + NaCl + KCl + H 2 O and the ternary subsystem LiCl + NaCl + H 2 O at 288.15 K were investigated. Each phase diagram of two systems was drawn. The phase diagram of LiCl + NaCl + H 2 O system contains two solid phase regions of crystallization LiCl·2H 2 O and NaCl. In the phase diagram of LiCl + NaCl + KCl + H 2 O system, there are three crystallization regions: LiCl·2H 2 O, NaCl and KCl respectively. In this paper, the solubilities of phase equilibria in two systems were calculated by Pitzer's model at 288.15 K. The predicted phase diagrams generally agree with the experimental phase diagrams.

CAS / MDL: 7647-14-5 7447-41-8
研究领域: 化学 · 物理化学
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Lubricants · 2017 ·Vol. 5 ·期 3 ·22 · IF 0

Tribological Investigation of Layered Zirconium Phosphate in Anhydrous Calcium Grease

Yingjing Dai,Wenxing Niu,Xiaosheng Zhang,Hong Xu,Jinxiang Dong

The tribological properties of α-zirconium phosphate particles as an additive in anhydrous calcium grease were studied by using an Optimol SRV-V oscillating reciprocating tester and a four-ball tester. Fortunately, α-Zr(HPO4)·H2O (α-ZrP) grease exhibits excellent properties in anti-friction and wear-resistant, load-carrying capacity, and extreme pressure properties. Scanning electron microscopy with energy dispersive X-ray spectroscopy (SEM-EDS) and 3D analysis show that α-ZrP particles appear to form a protective film allowing increased load capacity and operating frequency of the rubbed pairs. Meanwhile, α-ZrP particles can provide low friction coefficient and wear loss during a long-term test.Keywords:solid lubricants;α-Zr(HPO4)·H2O;anhydrous calcium grease

CAS / MDL: 1305-62-0
研究领域: 材料科学 · 摩擦学
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