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Simulation studies on metastable phase equilibria in the aqueous ternary systems (NaCl-MgCl

Tianlong DENG, Baojun ZHANG, Dongchan LI, Yafei GUO

Frontiers of Chemical Science and Engineering 2009, Volume 3, Issue 2,   Pages 172-175 doi: 10.1007/s11705-009-0048-1

Abstract: The solubilities and densities of the aqueous metastable ternary systems (NaCl-MgCl -H O) and (KCl-MgClOn the basis of the experimental results, the phase diagrams for those systems were plotted.

Keywords： green chemistry     solar pond technique     simulation     metastable phase equilibrium     solubility    

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Phase equilibrium of the ternary system of NH 4 Cl—CaCl 2 —H 2 O at 50°C

Xia LI, Junsheng YUAN, Zhiyong JI, Jianxin CHEN,

Frontiers of Chemical Science and Engineering 2010, Volume 4, Issue 1,   Pages 75-77 doi: 10.1007/s11705-009-0296-0

Abstract: The equilibrium data on the ternary system of NHCl—CaCl—HO at 50°C were investigatedThe experimental results show that there are three pure phase crystal areas of NHCl, 2NHCl·CaCl·3HO and CaCl·2HO, two mixture phase crystal areas of NHCl and 2NHCl·CaCl·3HO, andA new hydration double salt (2NHCl·CaCl·3HO) was found in the ternary equilibrium system for
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A computational toolbox for molecular property prediction based on quantum mechanics and quantitative structure-property relationship

Frontiers of Chemical Science and Engineering 2022, Volume 16, Issue 2,   Pages 152-167 doi: 10.1007/s11705-021-2060-z

Abstract: highlighting different aspects of the toolbox involving the predictions of heats of reaction and solid-liquid phase

Keywords： property     quantum mechanics     quantitative structure-property relationship     heat of reaction     solid-liquid phaseequilibrium    

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Thermodynamic analysis of reaction pathways and equilibrium yields for catalytic pyrolysis of naphtha

Frontiers of Chemical Science and Engineering 2022, Volume 16, Issue 12,   Pages 1700-1712 doi: 10.1007/s11705-022-2207-6

Abstract: Herein, for a better catalyst design and operation parameters optimization, the reaction pathways and equilibriumIn addition, the equilibrium yield of light olefins increased with increasing the chain length, and the

Keywords： naphtha     catalytic pyrolysis     reaction pathway     equilibrium yield    

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The Application of Local Search for Maximum Area to High Pressure Phase Equilibrium

Guo Jizhi,Liu Tao,Yuan Weikang

Strategic Study of CAE 2001, Volume 3, Issue 3,   Pages 56-60

Abstract: condition for global Gibbs energy minimization rather than only a necessary condition provided by the flash equilibriumLSAM (local search area method), which is a repeated search shrinking vicinities of the liquid and gas equilibriumThe experimental equilibrium data of benzene and propylene are used to demonstrate the merit of this

Keywords： Gibbs energy     VLE high pressure     VLE calculation method     benzene     propylene    

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Measurement and correlation of the solid-liquid equilibrium of 2-(

Yanhong SUN, Zhiyong LI, Chuang XIE, Wei CHEN, Cui ZHANG

Frontiers of Chemical Science and Engineering 2013, Volume 7, Issue 1,   Pages 110-115 doi: 10.1007/s11705-013-1316-7

Abstract: The binary solid-liquid equilibrium (SLE) of both compounds were predicted by integrated computer aided

Keywords： solid-liquid equilibrium (SLE)     eutectic     integrated computer aided system (ICAS)     TOPEM     correlation    

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Brown marine algae turbinaria conoides as biosorbent for Malachite green removal: Equilibrium and kinetic

R. RAJESH KANNAN, M. RAJASIMMAN, N. RAJAMOHAN, B. SIVAPRAKASH,

Frontiers of Environmental Science & Engineering 2010, Volume 4, Issue 1,   Pages 116-122 doi: 10.1007/s11783-010-0006-7

Abstract: Equilibrium studies were carried out to test the validity of the Langmuir ( = 66.6 mg/g and =

Keywords： Malachite green (MG)     Turbinaria conoides     marine algae     equilibrium studies     biosorption    

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Non-equilibrium model for catalytic distillation process

WANG Feng, ZHAO Ning, LI Junping, XIAO Fukui, WEI Wei, SUN Yuhan

Frontiers of Chemical Science and Engineering 2008, Volume 2, Issue 4,   Pages 379-384 doi: 10.1007/s11705-008-0071-7

Abstract: A new improved tri-diagonal method was developed for the non-equilibrium stage model of the catalyticThe non-equilibrium stage model was introduced for the catalytic distillation process of the dimethyl
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into nitrogen and sulfur co-doped carbon nanotubes for effective desulfurization of liquid phases: Equilibrium

Frontiers of Environmental Science & Engineering 2021, Volume 15, Issue 5, doi: 10.1007/s11783-021-1397-3

Abstract:

• Synthesis of NS-CNTS is used in a high desulfurization performance.

Keywords： Dibenzothiophene (DBT)     Tertiary methyl mercaptan     Adsorption     Carbon nano tube (CNT)     Desulfurization     Doping    

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Effects of a structurally related substance on the crystallization of paracetamol

Ali SALEEMI, I.I. ONYEMELUKWE, Zoltan NAGY

Frontiers of Chemical Science and Engineering 2013, Volume 7, Issue 1,   Pages 79-87 doi: 10.1007/s11705-013-1308-7

Abstract: effect on the nucleation kinetics was studied by measuring the induction time to nucleation and the metastableBoth the induction time and the metastable zone width were expressed as functions of the additive concentrationfound to cause significant inhibition to the nucleation by extending both the induction time and the metastable

Keywords： acetaminophen     metacetamol     crystallization     metastable zone width     induction time     supersaturation control    

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Microfluidic production of liposomes through liquid–liquid phase separation in ternary droplets

Frontiers of Chemical Science and Engineering 2022, Volume 16, Issue 6,   Pages 1017-1022 doi: 10.1007/s11705-021-2118-y

Abstract: For demonstration, we used butyl acetate-water-ethanol ternary mixtures as inner phase and an aqueoussolution of surfactants as outer phase to make oil-in-water droplets, which can evolve into water-in-oil-in-waterdouble emulsion droplets by liquid–liquid phase separation of ternary mixtures.

Keywords： microfluidics     liposomes     ternary droplets     phase separation    

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Removal of Rhodamine B from aqueous solutions and wastewater by walnut shells: kinetics, equilibrium

Jasmin Shah, M. Rasul Jan, Attaul Haq, Younas Khan

Frontiers of Chemical Science and Engineering 2013, Volume 7, Issue 4,   Pages 428-436 doi: 10.1007/s11705-013-1358-x

Abstract: An adsorption study of Rhodamine B (RB) dye from aqueous solutions was carried out using walnut shells pretreated by different methods. In addition to the effects of the pretreatment, the effects of various parameters like pH, adsorbent dose, contact time, initial dye concentration and temperature on the adsorption of RB was studied. The adsorption process was highly pH dependent and a maximum adsorption was achieved at pH 3.0. The best fit for the rates of dye adsorption was a pseudo-second-order kinetic model with good correlation coefficients ( >0.99). Langmuir isotherms were used to determine that the maximum loading capacity of the different walnut shells and the RB capacities ranged from 1.451–2.292 mg·g . The dye adsorption was also evaluated thermodynamically. Positive standard enthalpy (? °) values were obtained indicating that the RB adsorption process is endothermic as well as ? ° and ? ° values showed that adsorption process is spontaneous with an increased randomness at the solid-liquid interface. Desorption studies were carried out to explore the feasibility of regenerating the used walnut shells and it was found that 97.71%–99.17% of the retained RB was recovered with 0.1 mol?L NaOH solution. The walnut shells were also successfully used to remove RB from industrial effluents.

Keywords： Rhodamine B     walnut shell adsorption     kinetics     isotherms     regeneration    

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Inspection System of Carbonate Equilibrium for Groundwater

Liu Jiangang,Zheng Kexun,Fu Weining,Wu Shunhua

Strategic Study of CAE 2003, Volume 5, Issue 9,   Pages 61-64

Abstract: So features of carbonate equilibrium in carbonate rock depend on component of calcite.

Keywords： carbonate rock     groundwater     carbonate equilibrium     pH value    

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Advances and perspectives in catalysts for liquid-phase oxidation of cyclohexane

Hui LI, Yuanbin SHE, Tao WANG

Frontiers of Chemical Science and Engineering 2012, Volume 6, Issue 3,   Pages 356-368 doi: 10.1007/s11705-012-0903-3

Abstract: The latest progress and developments in catalysts for the oxidation of cyclohexane are reviewed. Catalytic systems for the oxidation of cyclohexane including metal supported, metal oxides, molecular sieves, metal substituted polyoxometalates, photocatalysts, organocatalysts, Gif systems, metal-organic catalysts and metalloporphyrins are discussed with a particular emphasis on metalloporphyrin catalytic systems. The advantages and disadvantages of these methods are summarized and analyzed. Finally, the development trends in the oxidation technology of cyclohexane are examined.

Keywords： cyclohexane     liquid-phase oxidation     catalysis    

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Enhancing the Combustion Performance of Metastable Al@AP/PVDF Nanocomposites by Doping with Graphene Article

Shuwen Chen, De-Yun Tang, Xue-Xue Zhang, Jie-Yao Lyu, Wei He, Peijin Liu, Qi-Long Yan

Engineering 2020, Volume 6, Issue 9,   Pages 1019-1027 doi: 10.1016/j.eng.2020.02.014

Abstract:

A new group of energetic metastable intermixed composites (MICs) was designed and fabricated by means

Keywords： Metastable intermixed composites     Al@AP/PVDF nanocomposites     Graphene oxide     Energy output     Combustion    

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Title Author Date Type Operation

Simulation studies on metastable phase equilibria in the aqueous ternary systems (NaCl-MgCl

Tianlong DENG, Baojun ZHANG, Dongchan LI, Yafei GUO

Journal Article

Phase equilibrium of the ternary system of NH 4 Cl—CaCl 2 —H 2 O at 50°C

Xia LI, Junsheng YUAN, Zhiyong JI, Jianxin CHEN,

Journal Article

A computational toolbox for molecular property prediction based on quantum mechanics and quantitative structure-property relationship

Journal Article

Thermodynamic analysis of reaction pathways and equilibrium yields for catalytic pyrolysis of naphtha

Journal Article

The Application of Local Search for Maximum Area to High Pressure Phase Equilibrium

Guo Jizhi,Liu Tao,Yuan Weikang

Journal Article

Measurement and correlation of the solid-liquid equilibrium of 2-(

Yanhong SUN, Zhiyong LI, Chuang XIE, Wei CHEN, Cui ZHANG

Journal Article

Brown marine algae turbinaria conoides as biosorbent for Malachite green removal: Equilibrium and kinetic

R. RAJESH KANNAN, M. RAJASIMMAN, N. RAJAMOHAN, B. SIVAPRAKASH,

Journal Article

Non-equilibrium model for catalytic distillation process

WANG Feng, ZHAO Ning, LI Junping, XIAO Fukui, WEI Wei, SUN Yuhan

Journal Article

into nitrogen and sulfur co-doped carbon nanotubes for effective desulfurization of liquid phases: Equilibrium

Journal Article

Effects of a structurally related substance on the crystallization of paracetamol

Ali SALEEMI, I.I. ONYEMELUKWE, Zoltan NAGY

Journal Article

Microfluidic production of liposomes through liquid–liquid phase separation in ternary droplets

Journal Article

Removal of Rhodamine B from aqueous solutions and wastewater by walnut shells: kinetics, equilibrium

Jasmin Shah, M. Rasul Jan, Attaul Haq, Younas Khan

Journal Article

Inspection System of Carbonate Equilibrium for Groundwater

Liu Jiangang,Zheng Kexun,Fu Weining,Wu Shunhua

Journal Article

Advances and perspectives in catalysts for liquid-phase oxidation of cyclohexane

Hui LI, Yuanbin SHE, Tao WANG

Journal Article

Enhancing the Combustion Performance of Metastable Al@AP/PVDF Nanocomposites by Doping with Graphene

Shuwen Chen, De-Yun Tang, Xue-Xue Zhang, Jie-Yao Lyu, Wei He, Peijin Liu, Qi-Long Yan

Journal Article