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Comprehensive performance analysis and optimization of 1,3-dimethylimidazolylium dimethylphosphate-water binary mixture

Gorakshnath TAKALKAR, Ahmad K. SLEITI

《能源前沿（英文）》 2022年 第16卷 第3期   页码 521-535 doi: 10.1007/s11708-021-0720-9

摘要： The energy and exergy analyses of the absorption refrigeration system (ARS) using H O-[mmim][DMP] mixture were investigated for a wide range of temperature. The equilibrium Dühring ( - - ) and enthalpy ( - - ) of mixture were assessed using the excess Gibbs free non-random two liquid (NRTL) model for a temperature range of 20°C to 140°C and from 0.1 to 0.9. The performance validation of the ARS cycle showed a better coefficient of performance (COP) of 0.834 for H O-[mmim][DMP] in comparison to NH -H O, H O-LiBr, H O-[emim][DMP], and H O-[emim][BF4]. Further, ARS performances with various operating temperatures of the absorber ( ), condenser ( ), generator ( ), and evaporator ( ) were simulated and optimized for a maximum COP and exergetic COP (ECOP). The effects of from 50°C to 150°C and and from 30°C to 50°C on COP and ECOP, the , , and circulation ratio (CR) of the ARS were evaluated and optimized for from 5°C to 15°C. The optimization revealed that needed to achieve a maximum COP which was more than that for a maximum ECOP. Therefore, this investigation provides criteria to select low grade heat source temperature. Most of the series flow of the cases of cooling water from the condenser to the absorber was found to be better than the absorber to the condenser.

关键词： ionic liquid driven absorption cycle     H2O-[mmim][DMP]     coefficient of performance (COP)     exergy analysis     thermodynamics mixture property    

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Kinetics and thermodynamics of the phosphine adsorption on the modified activated carbon

Bingnan REN

《化学科学与工程前沿（英文）》 2011年 第5卷 第2期   页码 203-208 doi: 10.1007/s11705-010-0571-0

摘要： The kinetics and the thermodynamics of phosphine (PH ) adsorption on the modified activated carbon have been explained for the adsorption process of PH . This study investigated the kinetic and thermodynamic properties of PH adsorption on the activated carbon impregnated with 5% HCl solution. The thermodynamic properties including PH adsorption isotherm and adsorption heat were separately investigated at 20°C, 70°C, 90°C. The results showed that the Freundlich-type isotherm equation described the isotherms well. The adsorption capacity increased with increasing temperature between 20°C and 70°C. Between 70°C and 90°C, the adsorption capacity decreased obviously with increasing temperature. The adsorption capacity reached the maximum at 70°C. By analyzing the results of the kinetics and the thermodynamics, we found that the adsorption of PH was dominated by physical adsorption at the lower temperature (20°C). Then with increasing temperature, chemical adsorption gradually dominated in the adsorption process. The adsorption capacity decreased at above 70°C is due to the exothermic effects in the process of adsorption.

关键词： adsorption     PH3     activated carbon     kinetics     thermodynamics    

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Adsorption of herring sperm DNA onto pine sawdust biochar: Thermodynamics and site energy distribution

《环境科学与工程前沿（英文）》 2022年 第16卷 第11期 doi: 10.1007/s11783-022-1579-7

摘要：

● Adsorption of environmental deoxyribonucleic acid on biochar was studied.

关键词： Environmental deoxyribonucleic acid     Antibiotic resistance genes     Biochar     Adsorption thermodynamics    

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Self-catalytic pyrolysis thermodynamics of waste printed circuit boards with co-existing metals

《环境科学与工程前沿（英文）》 2022年 第16卷 第11期 doi: 10.1007/s11783-022-1581-0

摘要：

● The co-existing metals in WPCBs has positive catalytic influence in pyrolysis.

关键词： Waste printed circuit board     Catalyst     Pyrolysis     Kinetics    

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Latest progress in numerical simulations on multiphase flow and thermodynamics in production of natural

Lin ZUO, Lixia SUN, Changfu YOU

《能源前沿（英文）》 2009年 第3卷 第2期   页码 152-159 doi: 10.1007/s11708-009-0017-x

摘要： Natural gas hydrates are promising potential alternative energy resources. Some studies on the multiphase flow and thermodynamics have been conducted to investigate the feasibility of gas production from hydrate dissociation. The methods for natural gas production are analyzed and several models describing the dissociation process are listed and compared. Two prevailing models, one for depressurization and the other for thermal stimulation, are discussed in detail. A comprehensive numerical method considering the multiphase flow and thermodynamics of gas production from various hydrate-bearing reservoirs is required to better understand the dissociation process of natural gas hydrate, which would be of great benefit to its future exploration and exploitation.

关键词： numerical simulation     natural gas hydrate     dissociation     thermodynamics     multiphase flow    

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A study on quality evaluation for bituminous mixture using X-ray CT

Satoshi TANIGUCHI, Keiichiro OGAWA, Jun OTANI, Itaru NISHIZAKI

《结构与土木工程前沿（英文）》 2013年 第7卷 第2期   页码 89-101 doi: 10.1007/s11709-013-0197-7

摘要： The objective of this paper is to propose a new quality evaluation method for asphalt concrete mixture using X-ray CT scanner. To achieve this aim, asphalt mixtures should be subjected to the X-ray CT scanning and its characteristics should be clarified. The approach employed in this study was as follows: 1) Coarse aggregate, fine aggregate, filler and bitumen were prepared; 2) dense-graded, coarse-graded and porous asphalt mixtures were made; 3) materials and mixtures were subjected to the X-ray CT scanning; 4) frequency of CT-value, threshold value, average slice CT-value, average segment CT-value were computed. In the material examination, CT-value of aggregate becomes smaller in the order of coarse aggregate, fine aggregate and filler and CT image of bitumen was nearly homogeneous. In the mixture examination, histograms of CT-value and four segmentation images made from CT images expressed the material and mixture characterization such as particle size and the difference in bitumen content and mixture type visibly and the bitumen content varies with the threshold values. In addition, the average segment CT-value without threshold value by dividing the fine aggregate from the coarse aggregate and average CT-value of the coarse aggregate, especially is highly correlated with average CT-value of the bitumen.

关键词： asphalt concrete mixture     aggregate     bitumen     bitumen content     quality evaluation     X-ray CT    

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

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

《化学科学与工程前沿（英文）》 2013年 第7卷 第4期   页码 428-436 doi: 10.1007/s11705-013-1358-x

摘要： 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.

关键词： Rhodamine B     walnut shell adsorption     kinetics     isotherms     regeneration    

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Fatigue of asphalt binder, mastic and mixture at low temperature

Dong WANG, Linbing WANG, Guoqing ZHOU

《结构与土木工程前沿（英文）》 2012年 第6卷 第2期   页码 166-175 doi: 10.1007/s11709-012-0157-7

摘要： The fatigue damage is one of the most common distresses observed on the asphalt concrete pavement. To thoroughly understand the fatigue of asphalt concrete, the behaviors of the major components of asphalt concrete under cyclic loading are investigated respectively in this study. A new experiment method is developed to evaluate the performances of asphalt binder, mastic and fine aggregates mixture under cyclic tensile loading. The fatigue test results of asphalt binder show that the fatigue performance of asphalt binder is closely related with loading magnitude, temperature and loading rate. Mastic specimens with different filler content are tested and the results indicate that mastic specimens with 30% filler content show better fatigue resistance and higher permanent strain. The micro-structure analysis of mastic and mixture indicates that the fatigue resistance is closely related with the air void content of specimen. 3D digital specimens are developed to model the fatigue of the asphalt binder, mastic and mixture specimens based on the finite element method (FEM). Fatigue damage of asphalt concrete is simplified by a damage model. With proper selection of damage parameters, the simulation results agree well with laboratory test results and can be used as a basis for future fatigue research.

关键词： fatigue     asphalt mixture     asphalt binder     mastic     finite element method (FEM)     X-ray tomography    

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Impacts of climate change on optimal mixture design of blended concrete considering carbonation and chloride

Xiao-Yong WANG

《结构与土木工程前沿（英文）》 2020年 第14卷 第2期   页码 473-486 doi: 10.1007/s11709-020-0608-5

摘要： Many studies on the mixture design of fly ash and slag ternary blended concrete have been conducted. However, these previous studies did not consider the effects of climate change, such as acceleration in the deterioration of durability, on mixture design. This study presents a procedure for the optimal mixture design of ternary blended concrete considering climate change and durability. First, the costs of CO emissions and material are calculated based on the concrete mixture and unit prices. Total cost is equal to the sum of material cost and CO emissions cost, and is set as the objective function of the optimization. Second, strength, slump, carbonation, and chloride ingress models are used to evaluate concrete properties. The effect of different climate change scenarios on carbonation and chloride ingress is considered. A genetic algorithm is used to find the optimal mixture considering various constraints. Third, illustrative examples are shown for mixture design of ternary blended concrete. The analysis results show that for ternary blended concrete exposed to an atmospheric environment, a rich mix is necessary to meet the challenge of climate change, and for ternary blended concrete exposed to a marine environment, the impact of climate change on mixture design is marginal.

关键词： ternary blended concrete     climate change     optimal mixture design     carbonation     chloride ingress    

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Simulation of abrasive flow machining process for 2D and 3D mixture models

Rupalika DASH,Kalipada MAITY

《机械工程前沿（英文）》 2015年 第10卷 第4期   页码 424-432 doi: 10.1007/s11465-015-0366-6

摘要：

Improvement of surface finish and material removal has been quite a challenge in a finishing operation such as abrasive flow machining (AFM). Factors that affect the surface finish and material removal are media viscosity, extrusion pressure, piston velocity, and particle size in abrasive flow machining process. Performing experiments for all the parameters and accurately obtaining an optimized parameter in a short time are difficult to accomplish because the operation requires a precise finish. Computational fluid dynamics (CFD) simulation was employed to accurately determine optimum parameters. In the current work, a 2D model was designed, and the flow analysis, force calculation, and material removal prediction were performed and compared with the available experimental data. Another 3D model for a swaging die finishing using AFM was simulated at different viscosities of the media to study the effects on the controlling parameters. A CFD simulation was performed by using commercially available ANSYS FLUENT. Two phases were considered for the flow analysis, and multiphase mixture model was taken into account. The fluid was considered to be a Newtonian fluid and the flow laminar with no wall slip.

关键词： abrasive flow machining (AFM)     computational fluid dynamics (CFD) modeling     mixture model    

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Simulation and analysis of grinding wheel based on Gaussian mixture model

Yulun CHI, Haolin LI

《机械工程前沿（英文）》 2012年 第7卷 第4期   页码 427-432 doi: 10.1007/s11465-012-0350-3

摘要：

This article presents an application of numerical simulation technique for the generation and analysis of the grinding wheel surface topographies. The ZETA 20 imaging and metrology microscope is employed to measure the surface topographies. The Gaussian mixture model (GMM) is used to transform the measured non-Gaussian field to Gaussian fields, and the simulated topographies are generated. Some numerical examples are used to illustrate the viability of the method. It shows that the simulated grinding wheel topographies are similar with the measured and can be effective used to study the abrasive grains and grinding mechanism.

关键词： grinding wheel     3D topographies measurement     Gaussian mixture model     simulation    

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Experimental study on capturing CO 2 greenhouse gas by mixture of ammonia and soil

Ying WU, Yifei WANG, Qinghua ZENG, Xin GONG, Zunhong YU,

《化学科学与工程前沿（英文）》 2009年 第3卷 第4期   页码 468-473 doi: 10.1007/s11705-009-0257-7

摘要： This paper presents our study on removal of carbon dioxide (CO) greenhouse gas emissions by using the mixture of ammonia and soil. CO capture capacity using this method is 15% higher than the sum of ammonia chemical absorption capacity and soil physical adsorption capacity. Scanning electron microscopy (SEM) and Fourier transform infrared spectroscopy (FTIR) are utilized to study this synergism. The removal effect is not only reflected in ammonia chemical reaction with CO. CO can also be absorbed by ammonium bicarbonate (NHHCO) crystal, which is the main component of the product, or wrapped in the pore of the crystal or packed in the gap between the crystal and the soil. CO can be permanently deposited as carbonated minerals in the subsoil earth layers.

关键词： electron microscopy     product     physical adsorption     capacity     spectroscopy    

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

《化学科学与工程前沿（英文）》 2022年 第16卷 第2期   页码 152-167 doi: 10.1007/s11705-021-2060-z

摘要： Chemical industry is always seeking opportunities to efficiently and economically convert raw materials to commodity chemicals and higher value-added chemical-based products. The life cycles of chemical products involve the procedures of conceptual product designs, experimental investigations, sustainable manufactures through appropriate chemical processes and waste disposals. During these periods, one of the most important keys is the molecular property prediction models associating molecular structures with product properties. In this paper, a framework combining quantum mechanics and quantitative structure-property relationship is established for fast molecular property predictions, such as activity coefficient, and so forth. The workflow of framework consists of three steps. In the first step, a database is created for collections of basic molecular information; in the second step, quantum mechanics-based calculations are performed to predict quantum mechanics-based/derived molecular properties (pseudo experimental data), which are stored in a database and further provided for the developments of quantitative structure-property relationship methods for fast predictions of properties in the third step. The whole framework has been carried out within a molecular property prediction toolbox. Two case studies highlighting different aspects of the toolbox involving the predictions of heats of reaction and solid-liquid phase equilibriums are presented.

关键词： molecular property     quantum mechanics     quantitative structure-property relationship     heat of reaction     solid-liquid phase equilibrium    

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Potassium carbonate-based ternary transition temperature mixture (deep eutectic analogues) for CO absorption

《环境科学与工程前沿（英文）》 2022年 第16卷 第7期 doi: 10.1007/s11783-021-1500-9

摘要：

•Addition of hindered amine increased thermal stability and viscosity of TTTM.

关键词： Ternary transition-temperature mixture     FT-IR and thermal stability analysis     Viscosity and correlation study     Eyring’s absolute rate theory     CO2 solubility     Density functional theory (DFT).    

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Optimization of polyurethane-bonded thin overlay mixture designation for airport pavement

Xianrui LI; Ling XU; Qidi ZONG; Fu JIANG; Xinyao YU; Jun WANG; Feipeng XIAO

《结构与土木工程前沿（英文）》 2022年 第16卷 第8期   页码 947-961 doi: 10.1007/s11709-022-0836-y

摘要： This research explored the application potential of PUM thin-overlay technology on airport rapid maintenance. The rapid curing process of polyurethane binder determines the limited time window for mixing and construction of polyurethane-bonded mixture (PUM), which presents significant difference with hot-mix asphalt (HMA) technology. Therefore, this research investigated and optimized the mix design of PUM for airport thin-overlay technology based on its thermosetting characteristics. First, limestone and basalt were comprehensively compared as an aggregate for PUM. Then, the effects of molding and curing conditions were studied in terms of mixing time, molding method, molding parameters and curing temperature. Statistical analysis was also conducted to evaluate the effects of gradation and particle size on PUM performances based on gray relational analysis (GRA), thus determining the key particle size to control PUM performances. Finally, the internal structural details of PUM were captured by X-ray CT scan test. The results demonstrated that it only took 12 hours to reach 75% of maximum strength at a curing temperature of 50 °C, indicating an efficient curing process and in turn allowing short traffic delay. The internal structural details of PUM presented distribution of tiny pores with few connective voids, guaranteeing waterproof property and high strength.

关键词： polyurethane-bonded mixture     mix design optimization     airport pavement     thin overlay     gray relational analysis    

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标题 作者 时间 类型 操作

Comprehensive performance analysis and optimization of 1,3-dimethylimidazolylium dimethylphosphate-water binary mixture

Gorakshnath TAKALKAR, Ahmad K. SLEITI

期刊论文

Kinetics and thermodynamics of the phosphine adsorption on the modified activated carbon

Bingnan REN

期刊论文

Adsorption of herring sperm DNA onto pine sawdust biochar: Thermodynamics and site energy distribution

期刊论文

Self-catalytic pyrolysis thermodynamics of waste printed circuit boards with co-existing metals

期刊论文

Latest progress in numerical simulations on multiphase flow and thermodynamics in production of natural

Lin ZUO, Lixia SUN, Changfu YOU

期刊论文

A study on quality evaluation for bituminous mixture using X-ray CT

Satoshi TANIGUCHI, Keiichiro OGAWA, Jun OTANI, Itaru NISHIZAKI

期刊论文

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

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

期刊论文

Fatigue of asphalt binder, mastic and mixture at low temperature

Dong WANG, Linbing WANG, Guoqing ZHOU

期刊论文

Impacts of climate change on optimal mixture design of blended concrete considering carbonation and chloride

Xiao-Yong WANG

期刊论文

Simulation of abrasive flow machining process for 2D and 3D mixture models

Rupalika DASH,Kalipada MAITY

期刊论文

Simulation and analysis of grinding wheel based on Gaussian mixture model

Yulun CHI, Haolin LI

期刊论文

Experimental study on capturing CO 2 greenhouse gas by mixture of ammonia and soil

Ying WU, Yifei WANG, Qinghua ZENG, Xin GONG, Zunhong YU,

期刊论文

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

期刊论文

Potassium carbonate-based ternary transition temperature mixture (deep eutectic analogues) for CO absorption

期刊论文

Optimization of polyurethane-bonded thin overlay mixture designation for airport pavement

Xianrui LI; Ling XU; Qidi ZONG; Fu JIANG; Xinyao YU; Jun WANG; Feipeng XIAO

期刊论文