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SCI和EI收录∣中国化工学会会刊
本期目录
2014年 第22卷 第6期 刊出日期:2014-06-28
    催化、动力学与反应工程
    Mixing Characteristics and Bubble Behavior in an Airlift Internal Loop Reactor with Low Aspect Ratio
    张伟鹏, 雍玉梅, 张广积, 杨超, 毛在砂
    Chinese Journal of Chemical Engineering. 2014, 22(6):  611-621.  doi:10.1016/S1004-9541(14)60089-6
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    The present study summarizes the results of macro- and micro-mixing characteristics in an airlift internal loop reactor with low aspect ratio (H/D≤5) using the electrolytic tracer response technique and the method of parallel competing reactions respectively. The micro-mixing has never been investigated in airlift loop reactors. The dual-tip electrical conductivity probe technique is used for measurement of local bubble behavior in the reactor. The effects of several operating parameters and geometric variables are investigated. It is found that the increase in superficial gas velocity corresponds to the increase in energy input, liquid circulation velocity and shear rate, decreasing the macro-mixing time and segregation index. Moreover, it is shown that top clearance and draft diameter affect flow resistance. However, the bubble redistribution with a screen mesh on the perforated plate distributor for macro-mixing is insignificant. The top region with a high energy dissipation rate is a suitable location for feeding reactants. The analysis of present experimental data provides a valuable insight into the interaction between gas and liquid phases for mixing and improves the understanding of intrinsic roles of hydrodynamics upon the reactor design and operating parameter selection.
    Total Reflux Operation of Multivessel Batch Distillation for Separation of Binary Mixtures
    唐克, 白鹏, 李广忠
    Chinese Journal of Chemical Engineering. 2014, 22(6):  622-627.  doi:10.1016/S1004-9541(14)60096-3
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    Multivessel batch distillation (MVBD) is mainly used to separate mixtures with more than two components. In this article, a new operation mode with MVBD is proposed for separation of binary mixtures under total reflux. A mathematic model is setup for the simulation. The proposed operation policy and the regular operation with constant reflux are compared theoretically and experimentally. The results show that the new operation mode has great advantages in time saving and operation flexibility. MVBD presents great potential for separation with high efficiency.
    A Modified Peng-Robinson Equation State for Prediction of Gas Adsorption Isotherm
    Ali Akbar Amooey
    Chinese Journal of Chemical Engineering. 2014, 22(6):  628-633.  doi:10.1016/S1004-9541(14)60090-2
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    This research proposes a modified two-dimensional Peng-Robinson equation model to predict adsorption isotherm in adsorbate-adsorbent systems. The parameters of the proposed model are calculated by using the optimization of experimental data for the different single gas adsorption systems at various temperatures. The experimental adsorption equilibrium data of adsorbate-adsorbent systems was compared with the calculated results in our proposed model and the two-dimensional Hill-deBoer equation model. The proposed model as indicated in the results shows a better prediction of the experimental results compared with two others.
    CO2 Leakage Identification in Geosequestration Based on Real Time Correlation Analysis Between Atmospheric O2 and CO2
    马登龙, 邓建强, 张早校
    Chinese Journal of Chemical Engineering. 2014, 22(6):  634-642.  doi:10.1016/S1004-9541(14)60094-X
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    The paper describes a method for monitoring CO2 leakage in geological carbon dioxide sequestration. A real time monitoring parameter, apparent leakage flux (ALF), is presented to monitor abnormal CO2 leakage, which can be calculated by atmospheric CO2 and O2 data. The computation shows that all ALF values are close to zero-line without the leakage. With a step change or linear perturbation of concentration to the initial CO2 concentration data with no leakage, ALF will deviate from background line. Perturbation tests prove that ALF method is sensitive to linear perturbation but insensitive to step change of concentration. An improved method is proposed based on real time analysis of surplus CO2 concentration in least square regression process, called apparent leakage flux from surplus analysis (ALFs), which is sensitive to both step perturbation and linear perturbations of concentration. ALF is capable of detecting concentration increase when the leakage occurs while ALFs is useful in all periods of leakage. Both ALF and ALFs are potential approaches to monitor CO2 leakage in geosequestration project.
    Fault Prediction Based on Dynamic Model and Grey Time Series Model in Chemical Processes
    田文德, 胡明刚, 李传坤
    Chinese Journal of Chemical Engineering. 2014, 22(6):  643-650.  doi:10.1016/S1004-9541(14)60087-2
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    This paper combines grey model with time series model and then dynamic model for rapid and in-depth fault prediction in chemical processes. Two combination methods are proposed. In one method, historical data is introduced into the grey time series model to predict future trend of measurement values in chemical process. These predicted measurements are then used in the dynamic model to retrieve the change of fault parameters by model based diagnosis algorithm. In another method, historical data is introduced directly into the dynamic model to retrieve historical fault parameters by model based diagnosis algorithm. These parameters are then predicted by the grey time series model. The two methods are applied to a gravity tank example. The case study demonstrates that the first method is more accurate for fault prediction.
    Optimizing Reactors Selection and Sequencing:Minimum Cost versus Minimum Volume
    Rachid Chebbi
    Chinese Journal of Chemical Engineering. 2014, 22(6):  651-656.  doi:10.1016/S1004-9541(14)60092-6
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    The present investigation targets minimum cost of reactors in series for the case of one single chemical reaction, considering plug flow and stirred tank reactor(s) in the sequence of flow reactors. Using Guthrie's cost correlations three typical cases were considered based on the profile of the reaction rate reciprocal versus conversion. Significant differences were found compared to the classical approach targeting minimum total reactor volume.
    Improved Kernel PLS-based Fault Detection Approach for Nonlinear Chemical Processes
    王丽, 侍洪波
    Chinese Journal of Chemical Engineering. 2014, 22(6):  657-663.  doi:10.1016/S1004-9541(14)60088-4
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    In this paper, an improved nonlinear process fault detection method is proposed based on modified kernel partial least squares (KPLS). By integrating the statistical local approach (SLA) into the KPLS framework, two new statistics are established to monitor changes in the underlying model. The new modeling strategy can avoid the Gaussian distribution assumption of KPLS. Besides, advantage of the proposed method is that the kernel latent variables can be obtained directly through the eigen value decomposition instead of the iterative calculation, which can improve the computing speed. The new method is applied to fault detection in the simulation benchmark of the Tennessee Eastman process. The simulation results show superiority on detection sensitivity and accuracy in comparison to KPLS monitoring.
    A Two-step Design Method for Shaft Work Targeting on Low-temperature Process
    罗祎青, 冯胜科, 孙长江, 袁希钢
    Chinese Journal of Chemical Engineering. 2014, 22(6):  664-668.  doi:10.1016/S1004-9541(14)60081-1
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    In low-temperature processes, there are interactions between heat exchanger network (HEN) and refrigeration system. The modification on HEN of the chilling train for increasing energy recovery does not always coordinate with the minimum shaft work consumption of the corresponding refrigeration system. In this paper, a systematic approach for optimizing low-temperature system is presented through mathematical method and exergy analysis. The possibility of "pockets", which appears as right nose section in the grand composite curve (EGCC) of the process, is first optimized. The EGCC with the pockets cutting down is designed as a separate part. A case study is used to illustrate the application of the approach for a HEN of a chilling train with propylene and ethylene refrigerant system in an ethylene production process.
    A LCA Based Biofuel Supply Chain Analysis Framework
    刘喆轩, 邱彤, 陈丙珍
    Chinese Journal of Chemical Engineering. 2014, 22(6):  669-681.  doi:10.1016/S1004-9541(14)60079-3
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    This paper presents a life cycle assessment (LCA) based biofuel supply chain (SC) analysis framework which enables the study of economic, energy and environmental (3E) performances by using multi-objective optimization. The economic objective is measured by the total annual profit, the energy objective is measured by the average fossil energy (FE) inputs per MJ biofuel and the environmental objective is measured by greenhouse gas (GHG) emissions per MJ biofuel. A multi-objective linear fractional programming (MOLFP) model with multi-conversion pathways is formulated based on the framework and is solved by using the ε-constraint method. The MOLFP problem is turned into a mixed integer linear programming (MILP) problem by setting up the total annual profit as the optimization objective and the average FE inputs per MJ biofuel and GHG emissions per MJ biofuel as constraints. In the case study, this model is used to design an experimental biofuel supply chain in China. A set of the weekly Pareto optimal solutions is obtained. Each non-inferior solution indicates the optimal locations and the amount of biomass produced, locations and capacities of conversion factories, locations and amount of biofuel being supplied in final markets and the flow of mass through the supply chain network (SCN). As the model reveals trade-offs among 3E criteria, we think the framework can be a good support tool of decision for the design of biofuel SC.
    Modeling and Optimization for Short-term Scheduling of Multipurpose Batch Plants
    陈国辉, 鄢烈祥, 史彬
    Chinese Journal of Chemical Engineering. 2014, 22(6):  682-689.  doi:10.1016/S1004-9541(14)60085-9
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    In the past two decades, short-term scheduling of multipurpose batch plants has received significant attention. Most scheduling problems are modeled using either state-task-network or resource-task-network (RTN) process representation. In this paper, an improved mixed integer linear programming model for short-term scheduling of multipurpose batch plants under maximization of profit is proposed based on RTN representation and unit-specific events. To solve the model, a hybrid algorithm based on line-up competition algorithm and linear programming is presented. The proposed model and hybrid algorithm are applied to two benchmark examples in literature. The simulation results show that the proposed model and hybrid algorithm are effective for short-term scheduling of multipurpose batch plants.
    Symbiosis Analysis on Industrial Ecological System
    汪刚, 冯宵, Khim Hoong Chu
    Chinese Journal of Chemical Engineering. 2014, 22(6):  690-698.  doi:10.1016/S1004-9541(14)60084-7
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    Industrial ecological system is a sustainable mode of modern industry development. Industrial symbiosis, a sub-field of industrial ecology, engages traditionally separate industries in a collective approach, involving exchange of materials, energy, water, and/or by-products, to enhance competitive ability and environmental performance. To construct a symbiosis analysis method, this article employs a number of parameters embodying information about materials, energy and economics as the main essential parameters in system analysis and introduces symbiosis profit and symbiotic consumption elements as the economic indicators. A modeling and simulation program is designed using the agent-based modeling approach to simulate the evolvement of a hypothetical coal-based industrial system and the change of symbiosis conditions in the process of construction is examined. The simulation program built using the Swarm library, which is a freely available multi-agent simulation package, provides a useful demonstration for the symbiosis analysis method.
    Phase Behavior of Sodium Dodecyl Sulfate-n-Butanol-Kerosene-Water Microemulsion System
    刘会娥, 张孝坤, 丁传芹, 陈爽, 齐选良
    Chinese Journal of Chemical Engineering. 2014, 22(6):  699-705.  doi:10.1016/S1004-9541(14)60095-1
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    Experiments were carried out to investigate the influences of cation from electrolytes and acidity/alkalinity on the phase behavior of sodium dodecyl sulfate-n-butanol-organics-water (with electrolytes) microemulsion system. The organics used is commercial kerosene. The volume ratio of water to organics is 1:1. The results show that the type and valence of electrolyte cations are important factors influencing the microemulsion behavior. Bivalent Ca2+ is more effective than monovalent K+ and Na+ for the formation of Winsor type III and II microemulsion. For electrolytes with the same monovalent cation Na+, #em/em#.e. NaCl and Na2CO3, anions in the electrolyte have some effect. Bivalent anion leads to a lower activity of cation Na+ than monovalent anion Cl-. NaOH (or KOH) behaves similar with NaCl (or KCl). When HCl is used as electrolyte, its acidity plays an important role. Phase inversion of microemulsion from type III (or II) to type I is observed through precipitation of Ca2+ using Na2CO3, neutralization of HCl by NaOH, and addition of water to the system, which releases the oil from the microemulsion.
    Roles of Biomolecules in the Biosynthesis of Silver Nanoparticles:Case of Gardenia jasminoides Extract
    吕芬芬, 高艺, 黄加乐, 孙道华, 李清彪
    Chinese Journal of Chemical Engineering. 2014, 22(6):  706-712.  doi:10.1016/S1004-9541(14)60086-0
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    Rapid development of biosynthesis of metal nanoparticles using plants has attracted extensive interests to further investigate this novel and eco-friendly method. In the biosynthesis process, the plant may act as reducing agent, capping agent or shape directing agent. However, identifying specific roles of various components in the plant is challenging. In this study, we use biosynthesis of silver nanoparticles with Gardenia jasminoides Ellis extract to address this issue. The formation process of silver nanoparticles is investigated and the nanoparticles are characterized with the ultraviolet-visible spectroscopy, Fourier transform infrared spectra and scanning electron microscopy. The results indicate that the Gardenia jasminoides Ellis extract can reduce silver ions to form silver nanoparticles, stabilize the nanoparticles, and affect the growth of silver nanocrystal to form silver nanowires. Only geniposide in the extract exhibits good shape-directing ability for silver nanowires. It is found that bovine albumin is a potential capping agent, whereas rutin, gallic acid and chlorogenic acid possess reducing and capping ability.
    Removal of Thiophenic Sulfur Compounds from Oil Using Chlorinated Polymers and Lewis Acid Mixture via Adsorption and Friedel-Crafts Alkylation Reaction
    宋红艳, 高家俊, 陈星羽, 何静, 李春喜
    Chinese Journal of Chemical Engineering. 2014, 22(6):  713-720.  doi:10.1016/S1004-9541(14)60093-8
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    For efficient removal of thiophenic sulfur (S-) compounds from oils, a novel method is proposed here, em.e. one-pot alkylation desulfurization (OADS), in which oil insoluble chlorinated polymer such as polyvinyl chloride (PVC) is used as the alkylating regent with Lewis acid as catalyst. The aromatic S-compounds are grafted to the polymer through Friedel-Crafts reaction and removed facilely along with the polymer. The OADS mechanism is identified by scanning electron microscope and analyzer with surface area and pore size of the polymer. The influence of some factors on the OADS is studied, e.g. the type and amount of chlorinated polymers and Lewis acids. It is proved that thiophene and benzothiophene can be removed efficiently from oil by PVC+AlCl3 mixture even in the presence of 25% (by mass) of benzene due to the synergetic effects of the adsorptive desulfurization of AlCl3 and the alkylation desulfurization of PVC.
    Photochemical Process Modeling and Analysis of Ozone Generation
    王冰, 邱彤, 陈丙珍
    Chinese Journal of Chemical Engineering. 2014, 22(6):  721-729.  doi:10.1016/S1004-9541(14)60080-X
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    Air pollution in modern city and industrial zones has become a serious public concern in recent years in China. Significance of air quality assessment and emission control strategy design is increasing. Most studies in China focus on particulate matter (PM), especially PM2.5, while few account for photochemical secondary air pollutions represented by ozone (O3). In this paper, a procedure for air quality simulation with comprehensive air quality model with extensions (CAMx) is demonstrated for studying the photochemical process and ozone generation in the troposphere. As a case study, the CAMx photochemical grid model is used to model ozone over southern part of Beijing city in winter, 2011. The input parameters to CAMx include emission sources, meteorology field data, terrain definition, photolysis status, initial and boundary conditions. The simulation results are verified by theoretical analysis of the ozone generation tendency. The simulated variation tendency of domain-wide average value of hourly ozone concentration coincides reasonably well with the theoretical analysis on the atmospheric photochemical process, demonstrating the effectiveness of the procedure. An integrated model system that cooperates with CAMx will be established in our future work.
    Unified Model of Purification Units in Hydrogen Networks
    吴思东, 王彧斐, 冯霄
    Chinese Journal of Chemical Engineering. 2014, 22(6):  730-733.  doi:10.1016/S1004-9541(14)60083-5
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    Purification processes are widely used in hydrogen networks of refineries to increase hydrogen reuse. In refineries, hydrogen purification techniques include hydrocarbon, hydrogen sulfide and CO removal units. In addition, light hydrocarbon recovery from the hydrogen source streams can also result in hydrogen purification. In order to simplify the superstructure and mathematical model of hydrogen network integration, the models of different purification processes are unified in this paper, including mass balance and the expressions for hydrogen recovery and impurity removal ratios, which are given for all the purification units in refineries. Based on the proposed unified model, a superstructure of hydrogen networks with purification processes is constructed.