Palladium nanoparticles were deposited on the amine-grafted glass fiber mat （GFM-NH2） catalyst support by a conventional impregnation process followed by the borohydride reduction in aqueous solution at room tempera...Palladium nanoparticles were deposited on the amine-grafted glass fiber mat （GFM-NH2） catalyst support by a conventional impregnation process followed by the borohydride reduction in aqueous solution at room temperature to create the designed Pd/GFM-NH2 catalyst. By the use of large size glass fiber mat without nano/mesopores as the catalyst support, the internal mass transfer limitations due to the existence of nano/mesopores on the catalyst support were eliminated and the Pd/GFM-NH2 catalyst could be easily separated from treated water due to the large size of the catalyst support. Batch experiments demonstrate its good catalytic reduction performance of Cr（VI） with formic acid as the reducing agent. It also demonstrated an efficient Cr（VI） removal and stability in a lab-prepared, packed fixed-bed tube reactor for the continuous treatment of Cr（VI）-containing water. Thus, it has a good potential for the catalytic reduction of Cr（VI） in the water treatment practice.展开更多
The estimation of the amount of reactive impurities in a loop reactor is of strategic importance to the propylene polymerization industry. It is essential to investigate the level of impurities in order to develop rel...The estimation of the amount of reactive impurities in a loop reactor is of strategic importance to the propylene polymerization industry. It is essential to investigate the level of impurities in order to develop reliable monitoring and control strategies. This paper described one approach based on generation function technique with the following two steps. First, a new mechanism for propylene polymerization was proposed by considering the effects of the reactive impurities in the material on the propylene polymerization. Second, a series of equations of population balance for the propylene polymerization in loop reactors were established based on the proposed mechanism. Accordingly, the equations were transformed into the mathematic matrix through the generation function technique to investigate the effects of the reactive impurities on the propylene polymerization. Significant effects of the reactive impurities were analyzed through computational simulation. The results show that the concentration of active centre on catalysts and the polymerization conversion both decrease with the increase of the initial concentration of any reactive impurity; hydrogen concentration decreases with the increase of the initial concentration of ethylene or butylenes, whereas, it increases with the increase of the initial concentration of propadiene; the simulated weight average molecular weight and the molecular weight distribution index of polymer resins both increase with the increase of the initial concentration of ethylene or butylenes. They decrease with the increase of the initial concentration of propadiene.展开更多
It is believed that whether the instantaneous objective function curves of plug-flow-reactor (PFR) and continuous-stirred-tank-reactor (CSTR) overlap or not, they have a consistent changing trend for complex reactions...It is believed that whether the instantaneous objective function curves of plug-flow-reactor (PFR) and continuous-stirred-tank-reactor (CSTR) overlap or not, they have a consistent changing trend for complex reactions (steady state, isothermal and constant volume). As a result of the relation of the objective functions (selectivity or yield) to the instantaneous objective functions (instantaneous selectivity or instantaneous reaction rate), the optimal reactor network configuration can be determined according to the changing trend of the instantaneous objective function curves. Further, a recent partition strategy for the reactor network synthesis based on the instantaneous objective function characteristic curves is proposed by extending the attainable region partition strategy from the concentration space to the instantaneous objective function-unreacted fraction of key reactant space. In this paper, the instantaneous objective function is closed to be the instantaneous selectivity and several samples are examined to illustrate the proposed method. The comparison with the previous work indicates it is a very convenient and practical systematic tool of the reactor network synthesis and seems also promising for overcoming the dimension limit of the attainable region partition strategy in the concentration space.展开更多
The present work aims to achieve a fast and accurate analytical solution of the point kinetics equations applied to subcritical reactors such as ADS (Accelerator-Driven System), assuming a linear reactivity and extern...The present work aims to achieve a fast and accurate analytical solution of the point kinetics equations applied to subcritical reactors such as ADS (Accelerator-Driven System), assuming a linear reactivity and external source variation. It was used a new set of point kinetics equations for subcritical systems based on the model proposed by Gandini & Salvatores. In this work it was employed the integrating factor method. The analytical solution for the case of interest was obtained by using only an approximation which consists of disregarding the term of the second derivative for neutron density in relation to time when compared with the other terms of the equation. And also, it is proposed an approximation for the upper incomplete gamma function found in the solution in order to make the computational processing faster. In addition, for purposes of validation and comparison a numerical solution was obtained by the finite differences method. Finally, it can be concluded that the obtained solution is accurate and has fast numerical processing time, especially when compared with the results of numerical solution by finite difference. One can also observe that the gamma approximation used achieve a high accuracy for the usual parameters. Thus we got satisfactory results when the solution is applied to practical situations, such as a reactor startup.展开更多
In this study,a multi-physics and multi-scale coupling program,Fluent/KMC-sub/NDK,was developed based on the user-defined functions(UDF)of Fluent,in which the KMC-sub-code is a sub-channel thermal-hydraulic code and t...In this study,a multi-physics and multi-scale coupling program,Fluent/KMC-sub/NDK,was developed based on the user-defined functions(UDF)of Fluent,in which the KMC-sub-code is a sub-channel thermal-hydraulic code and the NDK code is a neutron diffusion code.The coupling program framework adopts the"master-slave"mode,in which Fluent is the master program while NDK and KMC-sub are coupled internally and compiled into the dynamic link library(DLL)as slave codes.The domain decomposition method was adopted,in which the reactor core was simulated by NDK and KMC-sub,while the rest of the primary loop was simulated using Fluent.A simulation of the reactor shutdown process of M2LFR-1000 was carried out using the coupling program,and the code-to-code verification was performed with ATHLET,demonstrating a good agreement,with absolute deviation was smaller than 0.2%.The results show an obvious thermal stratification phenomenon during the shutdown process,which occurs 10 s after shutdown,and the change in thermal stratification phenomena is also captured by the coupling program.At the same time,the change in the neutron flux density distribution of the reactor was also obtained.展开更多
Recently, the work function （WF） changes in metallic and ceramic materials to be potentially used in future fusion reactors have been examined by means of Kelvin probe （KP）, under He ion irradiation in high energy...Recently, the work function （WF） changes in metallic and ceramic materials to be potentially used in future fusion reactors have been examined by means of Kelvin probe （KP）, under He ion irradiation in high energy （MeV） and / or low energy （500 eV） ranges. The results of polycrystalline Ni samples indicate that the 1 MeV beam only induces decrease in the WF within the experimental fluence range; whereas the irradiation of 500 eV beam results in decrease in the WF firstly, then increase till saturation. A dual layer surface model is employed to explain the observed phenomena, together with computer simulation results by SRIM code. Charges buildup on the surface of lithium ceramics has been found to greatly influence the probe output, which can be explained qualitatively using a model concerning an induction electric field due to external field and free charges on the ceramic surface.展开更多
An approximation method using to estimate the influence of the uncertainties of the neutron flux characteristic parameters in the irradiation positions on the NAA results using k0-standardization technique was present...An approximation method using to estimate the influence of the uncertainties of the neutron flux characteristic parameters in the irradiation positions on the NAA results using k0-standardization technique was presented. Those are the epithermal reactor neutron spectrum shape-factor α, the effective resonace energy Ε for a given nuclide and the thermal to epithermal neutron flux ratio f. The method is applied to estimate the effect of the uncertainties in the determination of α Ε, and f on final NAA results for some irradiation channels of the Dalat reactor. It also shows that presented method is suitable in practical use for the estimation of the errors due to the uncertainty of the neutron flux characteristic parameters at the irradiation position.展开更多
本文研究了好氧阶段溶解氧(DO)浓度对序批式反应器(SBR)脱氮性能、生物酶活性、微生物群落和氮代谢功能基因的影响。随着好氧阶段DO浓度从5~6 mg/L降低至2~3 mg/L,SBR活性污泥系统的硝化速率和硝化酶活性逐渐降低,而反硝化速率和反硝化...本文研究了好氧阶段溶解氧(DO)浓度对序批式反应器(SBR)脱氮性能、生物酶活性、微生物群落和氮代谢功能基因的影响。随着好氧阶段DO浓度从5~6 mg/L降低至2~3 mg/L,SBR活性污泥系统的硝化速率和硝化酶活性逐渐降低,而反硝化速率和反硝化酶活性逐渐升高。宏基因组学分析表明,SBR活性污泥系统的微生物群落随好氧阶段DO浓度的下降发生明显变化,典型硝化菌属的相对丰度逐渐减少,而多种反硝化菌属的相对丰度逐渐增加。氮代谢过程中,好氧阶段DO浓度的降低抑制了与硝化过程相关的功能基因和关键酶的相对丰度,而促进了与反硝化过程相关的功能基因和关键酶的相对丰度,从基因角度解释了SBR硝化性能降低和反硝化性能提升的原因。通过京都基因与基因组百科全书(Kyoto encyclopedia of genes and genomes,KEGG)数据库分析可知,好氧阶段DO浓度的降低对活性污泥系统的碳代谢过程产生明显的抑制作用,而对能量产生和电子转移过程有一定的促进作用。本研究深入探讨了好氧阶段DO浓度对SBR生物脱氮过程的影响,为SBR好氧阶段DO参数设置提供了理论依据。展开更多
基金supported by the Basic Science Innovation Program of Shenyang National Laboratory for Materials Science(Grant Nos.Y4N56R1161 and Y4N56F2161)the National Natural Science Foundation of China(Grant No.51502305)
文摘Palladium nanoparticles were deposited on the amine-grafted glass fiber mat （GFM-NH2） catalyst support by a conventional impregnation process followed by the borohydride reduction in aqueous solution at room temperature to create the designed Pd/GFM-NH2 catalyst. By the use of large size glass fiber mat without nano/mesopores as the catalyst support, the internal mass transfer limitations due to the existence of nano/mesopores on the catalyst support were eliminated and the Pd/GFM-NH2 catalyst could be easily separated from treated water due to the large size of the catalyst support. Batch experiments demonstrate its good catalytic reduction performance of Cr（VI） with formic acid as the reducing agent. It also demonstrated an efficient Cr（VI） removal and stability in a lab-prepared, packed fixed-bed tube reactor for the continuous treatment of Cr（VI）-containing water. Thus, it has a good potential for the catalytic reduction of Cr（VI） in the water treatment practice.
基金This work was financially supported by the National Natural Science Foundation of China (No. 20406016)Fujian Petrochemical Company of SINOPEC (No. MS/FJ-08-JS-15-2005-01)
文摘The estimation of the amount of reactive impurities in a loop reactor is of strategic importance to the propylene polymerization industry. It is essential to investigate the level of impurities in order to develop reliable monitoring and control strategies. This paper described one approach based on generation function technique with the following two steps. First, a new mechanism for propylene polymerization was proposed by considering the effects of the reactive impurities in the material on the propylene polymerization. Second, a series of equations of population balance for the propylene polymerization in loop reactors were established based on the proposed mechanism. Accordingly, the equations were transformed into the mathematic matrix through the generation function technique to investigate the effects of the reactive impurities on the propylene polymerization. Significant effects of the reactive impurities were analyzed through computational simulation. The results show that the concentration of active centre on catalysts and the polymerization conversion both decrease with the increase of the initial concentration of any reactive impurity; hydrogen concentration decreases with the increase of the initial concentration of ethylene or butylenes, whereas, it increases with the increase of the initial concentration of propadiene; the simulated weight average molecular weight and the molecular weight distribution index of polymer resins both increase with the increase of the initial concentration of ethylene or butylenes. They decrease with the increase of the initial concentration of propadiene.
基金Supported by the National Natural Science Foundation of China (No. 29776028, No. 29836140).
文摘It is believed that whether the instantaneous objective function curves of plug-flow-reactor (PFR) and continuous-stirred-tank-reactor (CSTR) overlap or not, they have a consistent changing trend for complex reactions (steady state, isothermal and constant volume). As a result of the relation of the objective functions (selectivity or yield) to the instantaneous objective functions (instantaneous selectivity or instantaneous reaction rate), the optimal reactor network configuration can be determined according to the changing trend of the instantaneous objective function curves. Further, a recent partition strategy for the reactor network synthesis based on the instantaneous objective function characteristic curves is proposed by extending the attainable region partition strategy from the concentration space to the instantaneous objective function-unreacted fraction of key reactant space. In this paper, the instantaneous objective function is closed to be the instantaneous selectivity and several samples are examined to illustrate the proposed method. The comparison with the previous work indicates it is a very convenient and practical systematic tool of the reactor network synthesis and seems also promising for overcoming the dimension limit of the attainable region partition strategy in the concentration space.
文摘The present work aims to achieve a fast and accurate analytical solution of the point kinetics equations applied to subcritical reactors such as ADS (Accelerator-Driven System), assuming a linear reactivity and external source variation. It was used a new set of point kinetics equations for subcritical systems based on the model proposed by Gandini & Salvatores. In this work it was employed the integrating factor method. The analytical solution for the case of interest was obtained by using only an approximation which consists of disregarding the term of the second derivative for neutron density in relation to time when compared with the other terms of the equation. And also, it is proposed an approximation for the upper incomplete gamma function found in the solution in order to make the computational processing faster. In addition, for purposes of validation and comparison a numerical solution was obtained by the finite differences method. Finally, it can be concluded that the obtained solution is accurate and has fast numerical processing time, especially when compared with the results of numerical solution by finite difference. One can also observe that the gamma approximation used achieve a high accuracy for the usual parameters. Thus we got satisfactory results when the solution is applied to practical situations, such as a reactor startup.
基金supported by Science and Technology on Reactor System Design Technology Laboratory,Chengdu,China(LRSDT2020106)
文摘In this study,a multi-physics and multi-scale coupling program,Fluent/KMC-sub/NDK,was developed based on the user-defined functions(UDF)of Fluent,in which the KMC-sub-code is a sub-channel thermal-hydraulic code and the NDK code is a neutron diffusion code.The coupling program framework adopts the"master-slave"mode,in which Fluent is the master program while NDK and KMC-sub are coupled internally and compiled into the dynamic link library(DLL)as slave codes.The domain decomposition method was adopted,in which the reactor core was simulated by NDK and KMC-sub,while the rest of the primary loop was simulated using Fluent.A simulation of the reactor shutdown process of M2LFR-1000 was carried out using the coupling program,and the code-to-code verification was performed with ATHLET,demonstrating a good agreement,with absolute deviation was smaller than 0.2%.The results show an obvious thermal stratification phenomenon during the shutdown process,which occurs 10 s after shutdown,and the change in thermal stratification phenomena is also captured by the coupling program.At the same time,the change in the neutron flux density distribution of the reactor was also obtained.
文摘Recently, the work function （WF） changes in metallic and ceramic materials to be potentially used in future fusion reactors have been examined by means of Kelvin probe （KP）, under He ion irradiation in high energy （MeV） and / or low energy （500 eV） ranges. The results of polycrystalline Ni samples indicate that the 1 MeV beam only induces decrease in the WF within the experimental fluence range; whereas the irradiation of 500 eV beam results in decrease in the WF firstly, then increase till saturation. A dual layer surface model is employed to explain the observed phenomena, together with computer simulation results by SRIM code. Charges buildup on the surface of lithium ceramics has been found to greatly influence the probe output, which can be explained qualitatively using a model concerning an induction electric field due to external field and free charges on the ceramic surface.
文摘An approximation method using to estimate the influence of the uncertainties of the neutron flux characteristic parameters in the irradiation positions on the NAA results using k0-standardization technique was presented. Those are the epithermal reactor neutron spectrum shape-factor α, the effective resonace energy Ε for a given nuclide and the thermal to epithermal neutron flux ratio f. The method is applied to estimate the effect of the uncertainties in the determination of α Ε, and f on final NAA results for some irradiation channels of the Dalat reactor. It also shows that presented method is suitable in practical use for the estimation of the errors due to the uncertainty of the neutron flux characteristic parameters at the irradiation position.
文摘本文研究了好氧阶段溶解氧(DO)浓度对序批式反应器(SBR)脱氮性能、生物酶活性、微生物群落和氮代谢功能基因的影响。随着好氧阶段DO浓度从5~6 mg/L降低至2~3 mg/L,SBR活性污泥系统的硝化速率和硝化酶活性逐渐降低,而反硝化速率和反硝化酶活性逐渐升高。宏基因组学分析表明,SBR活性污泥系统的微生物群落随好氧阶段DO浓度的下降发生明显变化,典型硝化菌属的相对丰度逐渐减少,而多种反硝化菌属的相对丰度逐渐增加。氮代谢过程中,好氧阶段DO浓度的降低抑制了与硝化过程相关的功能基因和关键酶的相对丰度,而促进了与反硝化过程相关的功能基因和关键酶的相对丰度,从基因角度解释了SBR硝化性能降低和反硝化性能提升的原因。通过京都基因与基因组百科全书(Kyoto encyclopedia of genes and genomes,KEGG)数据库分析可知,好氧阶段DO浓度的降低对活性污泥系统的碳代谢过程产生明显的抑制作用,而对能量产生和电子转移过程有一定的促进作用。本研究深入探讨了好氧阶段DO浓度对SBR生物脱氮过程的影响,为SBR好氧阶段DO参数设置提供了理论依据。
