A novel control strategy for a continuous stirred tank reactor(CSTR)system,which has the typical characteristic of strongly pronounced nonlinearity,multiple operating points,and a wide operating range,is initiated fro...A novel control strategy for a continuous stirred tank reactor(CSTR)system,which has the typical characteristic of strongly pronounced nonlinearity,multiple operating points,and a wide operating range,is initiated from the point of hybrid systems.The proposed scheme makes full use of the modeling power of mixed logical dy- namical(MLD)systems to describe the highly nonlinear dynamics and multiple operating points in a unified framework as a hybrid system,and takes advantage of the good control quality of model predictive control(MPC) to design a controller.Thus,this approach avoids oscillation during switching between sub-systems,helps to relieve shaking in transition,and augments the stability robustness of the whole system,and finally achieves optimal(i.e. fast and smooth)transition between operating points.The simulation results demonstrate that the presented ap- proach has a satisfactory performance.展开更多
Continuous Stirred Tank Reactors (CSTR) are used ubiquitously in chemical process industry for mixing, reactions and crystallizations. The purpose of this research is to study the effect of solute concentration (sodiu...Continuous Stirred Tank Reactors (CSTR) are used ubiquitously in chemical process industry for mixing, reactions and crystallizations. The purpose of this research is to study the effect of solute concentration (sodium chloride) on the stirrer speed in a CSTR. The experimental method used in this research is the stop watch and beaker method. The behavior pattern of the fluid in a CSTR can be experimentally verified as an alternative to the mathematical model. The tracer experiments were carried out. The effect of different parameters such as stirring speed, concentration at a steady time interval was analyzed. Experimental data obtained at 0.6 M and 160 rpm gave a curve that is in close agreement to that of theoretical or mathematical model. In other words, the results obtained at a concentration of 0.6 M and 160 rpm are in close agreement with that of early researchers. The paper is divided into five main sections: the first section immediately after the abstract is the introductory section that is basically a review of literature;the second section takes care of the materials and methods;the third section is the experimental procedure and this section takes the shut-down procedure and data processing into consideration;the fourth section is the discussion of experimental results and the last section is the conclusion of the paper.展开更多
Understanding the residence time distribution(RTD)of a continuous hydrothermal reactor is of great significance to improve product quality and reaction efficiency.In this work,an on-line measurement system is attached...Understanding the residence time distribution(RTD)of a continuous hydrothermal reactor is of great significance to improve product quality and reaction efficiency.In this work,an on-line measurement system is attached to a continuous reactor to investigate the characteristics of RTD.An approach that can accurately fit and describe the experimental measured RTD curve by finding characteristic values is proposed for analysis and comparison.The RTD curves of three experiment groups are measured and the characteristic values are calculated.Results show that increasing total flow rate and extending effective reactor length have inverse effect on average residence time,but they both cause the reactor to approach a plug flow reactor and improve the materials leading.The branch flow rate fraction has no significant effect on RTD characteristics in the scope of the present work except the weak negative correlation with the average residence time.Besides,the natural convection stirring effect can also increase the average residence time,especially when the forced flow is weak.The analysis reveals that it is necessary to consider the matching of natural convection,forced flow and reactor size to control RTD when designing the hydrothermal reactor and working conditions.展开更多
Difluoromethane is typically produced vialiquid-phase fluorination as performed in a batch reactor.However,this process suffers from some problems,e.g.,severe corrosion of the reactor,high safety risk,and the regenera...Difluoromethane is typically produced vialiquid-phase fluorination as performed in a batch reactor.However,this process suffers from some problems,e.g.,severe corrosion of the reactor,high safety risk,and the regeneration of the catalyst.In this paper,a flow process as performed in the tubular reactor was designed.The optimum conditions for continuous synthesis of difluoromethane were obtained as follows:the reaction temperature was 100℃,the molar ratio of dichloromethane to hydrogen fluoride was 1.6:1 and the reaction time was 300 s.The operation of the cyclic process was stable for 24 h with the conversion per pass of hydrogen fluoride up to 16.2%.The unreacted raw materials were easily reused.The deactivation of the common catalyst,antimony pentachloride,was investigated by catalyst concentration curve and XPS analysis.The approach proposed in this work is proven to be safe,efficient and low amount of catalyst.展开更多
A model of the continuous melt transesterification process of bisphenol-A and diphenyl carbonate in a continuous stirred tank reactor to produce polycarbonate is presented. The model is developed by using the mo-lecul...A model of the continuous melt transesterification process of bisphenol-A and diphenyl carbonate in a continuous stirred tank reactor to produce polycarbonate is presented. The model is developed by using the mo-lecular species model of polycarbonate melt polycondensation and the modeling method of reactive flash. Liquid phase is treated as perfect mixed flow and the vapor phase is assumed following the ideal gas law. With this model, the continuous melt transesterification process of bisphenol-A and diphenyl carbonate is examined with respect to different process parameters.展开更多
Erlotinib is an orally administered, highly effective, specific epidermal growth factor receptor tyrosine kinase inhibitor, used to treat non-small cell lung cancer and pancreatic cancer. The traditional synthetic met...Erlotinib is an orally administered, highly effective, specific epidermal growth factor receptor tyrosine kinase inhibitor, used to treat non-small cell lung cancer and pancreatic cancer. The traditional synthetic methods for Erlotinib exhibit long reaction time and safety concern. Herein, we describe a novel five-step route for the synthesis of Erlotinib in flow. These five steps comprise etherification, nitration, reduction,addition and cyclization reactions. All steps were optimized and converted to continuous flow process,which drastically reduces the reaction time and considerably improves the process safety as well as the total yield. Enabled by five continuous flow units, Erlotinib is efficiently afforded with an E-factor of 38,an overall yield of 83%, and a total residence time of 25.1 min. Majority steps in this process have been optimized for quantitative conversion, which offers the possibility of telescoping the entire process.展开更多
Destruction of organic contaminants in water by ozonation is a gas-liquid process which involves ozone mass transfer and fast irreversible chemical reactions. Ozonation reactor design and process optimizing require th...Destruction of organic contaminants in water by ozonation is a gas-liquid process which involves ozone mass transfer and fast irreversible chemical reactions. Ozonation reactor design and process optimizing require the modeling of the gas-liquid interactions within the reactor. In this paper a theoretical model combining the fluid dynamic and reaction kinetic parameters is proposed for predicting the destruction rates of organic pollutants in a semi-batch stirred-tank reactor by ozonation. A simple expression for the enhancement factor as our previous work has been applied to evaluate the chemical mass transfer coefficient in ozone absorption. 2,4-dichlorophenol (2,4-DCP) and 2,6-DCP or their mixture are chosen as the model compounds for simulating, and the predicted DCP concentrations are compared with some measured data.展开更多
基金Supported by the National Natural Science Foundation of China （No.60404018） and the State Key Development Program for Basic Research of China （No.2002CB312200）.
文摘A novel control strategy for a continuous stirred tank reactor(CSTR)system,which has the typical characteristic of strongly pronounced nonlinearity,multiple operating points,and a wide operating range,is initiated from the point of hybrid systems.The proposed scheme makes full use of the modeling power of mixed logical dy- namical(MLD)systems to describe the highly nonlinear dynamics and multiple operating points in a unified framework as a hybrid system,and takes advantage of the good control quality of model predictive control(MPC) to design a controller.Thus,this approach avoids oscillation during switching between sub-systems,helps to relieve shaking in transition,and augments the stability robustness of the whole system,and finally achieves optimal(i.e. fast and smooth)transition between operating points.The simulation results demonstrate that the presented ap- proach has a satisfactory performance.
文摘Continuous Stirred Tank Reactors (CSTR) are used ubiquitously in chemical process industry for mixing, reactions and crystallizations. The purpose of this research is to study the effect of solute concentration (sodium chloride) on the stirrer speed in a CSTR. The experimental method used in this research is the stop watch and beaker method. The behavior pattern of the fluid in a CSTR can be experimentally verified as an alternative to the mathematical model. The tracer experiments were carried out. The effect of different parameters such as stirring speed, concentration at a steady time interval was analyzed. Experimental data obtained at 0.6 M and 160 rpm gave a curve that is in close agreement to that of theoretical or mathematical model. In other words, the results obtained at a concentration of 0.6 M and 160 rpm are in close agreement with that of early researchers. The paper is divided into five main sections: the first section immediately after the abstract is the introductory section that is basically a review of literature;the second section takes care of the materials and methods;the third section is the experimental procedure and this section takes the shut-down procedure and data processing into consideration;the fourth section is the discussion of experimental results and the last section is the conclusion of the paper.
基金supported by the National Natural Science Foundation of China(52242609)the National Key R&D Program of China(2020YFA0714400)。
文摘Understanding the residence time distribution(RTD)of a continuous hydrothermal reactor is of great significance to improve product quality and reaction efficiency.In this work,an on-line measurement system is attached to a continuous reactor to investigate the characteristics of RTD.An approach that can accurately fit and describe the experimental measured RTD curve by finding characteristic values is proposed for analysis and comparison.The RTD curves of three experiment groups are measured and the characteristic values are calculated.Results show that increasing total flow rate and extending effective reactor length have inverse effect on average residence time,but they both cause the reactor to approach a plug flow reactor and improve the materials leading.The branch flow rate fraction has no significant effect on RTD characteristics in the scope of the present work except the weak negative correlation with the average residence time.Besides,the natural convection stirring effect can also increase the average residence time,especially when the forced flow is weak.The analysis reveals that it is necessary to consider the matching of natural convection,forced flow and reactor size to control RTD when designing the hydrothermal reactor and working conditions.
基金financial support from the National Natural Science Foundation of China(21878265,21606104)the National Key Research and Development Program of China(2016YFB0301800)。
文摘Difluoromethane is typically produced vialiquid-phase fluorination as performed in a batch reactor.However,this process suffers from some problems,e.g.,severe corrosion of the reactor,high safety risk,and the regeneration of the catalyst.In this paper,a flow process as performed in the tubular reactor was designed.The optimum conditions for continuous synthesis of difluoromethane were obtained as follows:the reaction temperature was 100℃,the molar ratio of dichloromethane to hydrogen fluoride was 1.6:1 and the reaction time was 300 s.The operation of the cyclic process was stable for 24 h with the conversion per pass of hydrogen fluoride up to 16.2%.The unreacted raw materials were easily reused.The deactivation of the common catalyst,antimony pentachloride,was investigated by catalyst concentration curve and XPS analysis.The approach proposed in this work is proven to be safe,efficient and low amount of catalyst.
基金Supported by the National Natural Science Foundation of China (No.10472034, No.10590351) the Key Technologies R&DProgram of "the 10th Five Year Plan" of China (No.2001BA303B-02).
文摘A model of the continuous melt transesterification process of bisphenol-A and diphenyl carbonate in a continuous stirred tank reactor to produce polycarbonate is presented. The model is developed by using the mo-lecular species model of polycarbonate melt polycondensation and the modeling method of reactive flash. Liquid phase is treated as perfect mixed flow and the vapor phase is assumed following the ideal gas law. With this model, the continuous melt transesterification process of bisphenol-A and diphenyl carbonate is examined with respect to different process parameters.
基金the National Natural Science Foundation of China(Nos.21878088, 21476077)Key Projects of Shanghai Science and Technology Commission (No.18DZ1112703) for financial support。
文摘Erlotinib is an orally administered, highly effective, specific epidermal growth factor receptor tyrosine kinase inhibitor, used to treat non-small cell lung cancer and pancreatic cancer. The traditional synthetic methods for Erlotinib exhibit long reaction time and safety concern. Herein, we describe a novel five-step route for the synthesis of Erlotinib in flow. These five steps comprise etherification, nitration, reduction,addition and cyclization reactions. All steps were optimized and converted to continuous flow process,which drastically reduces the reaction time and considerably improves the process safety as well as the total yield. Enabled by five continuous flow units, Erlotinib is efficiently afforded with an E-factor of 38,an overall yield of 83%, and a total residence time of 25.1 min. Majority steps in this process have been optimized for quantitative conversion, which offers the possibility of telescoping the entire process.
文摘Destruction of organic contaminants in water by ozonation is a gas-liquid process which involves ozone mass transfer and fast irreversible chemical reactions. Ozonation reactor design and process optimizing require the modeling of the gas-liquid interactions within the reactor. In this paper a theoretical model combining the fluid dynamic and reaction kinetic parameters is proposed for predicting the destruction rates of organic pollutants in a semi-batch stirred-tank reactor by ozonation. A simple expression for the enhancement factor as our previous work has been applied to evaluate the chemical mass transfer coefficient in ozone absorption. 2,4-dichlorophenol (2,4-DCP) and 2,6-DCP or their mixture are chosen as the model compounds for simulating, and the predicted DCP concentrations are compared with some measured data.
