Due to the restricted satellite payloads in LEO mega-constellation networks(LMCNs),remote sensing image analysis,online learning and other big data services desirably need onboard distributed processing(OBDP).In exist...Due to the restricted satellite payloads in LEO mega-constellation networks(LMCNs),remote sensing image analysis,online learning and other big data services desirably need onboard distributed processing(OBDP).In existing technologies,the efficiency of big data applications(BDAs)in distributed systems hinges on the stable-state and low-latency links between worker nodes.However,LMCNs with high-dynamic nodes and long-distance links can not provide the above conditions,which makes the performance of OBDP hard to be intuitively measured.To bridge this gap,a multidimensional simulation platform is indispensable that can simulate the network environment of LMCNs and put BDAs in it for performance testing.Using STK's APIs and parallel computing framework,we achieve real-time simulation for thousands of satellite nodes,which are mapped as application nodes through software defined network(SDN)and container technologies.We elaborate the architecture and mechanism of the simulation platform,and take the Starlink and Hadoop as realistic examples for simulations.The results indicate that LMCNs have dynamic end-to-end latency which fluctuates periodically with the constellation movement.Compared to ground data center networks(GDCNs),LMCNs deteriorate the computing and storage job throughput,which can be alleviated by the utilization of erasure codes and data flow scheduling of worker nodes.展开更多
The mechanical properties and failure mechanism of lightweight aggregate concrete(LWAC)is a hot topic in the engineering field,and the relationship between its microstructure and macroscopic mechanical properties is a...The mechanical properties and failure mechanism of lightweight aggregate concrete(LWAC)is a hot topic in the engineering field,and the relationship between its microstructure and macroscopic mechanical properties is also a frontier research topic in the academic field.In this study,the image processing technology is used to establish a micro-structure model of lightweight aggregate concrete.Through the information extraction and processing of the section image of actual light aggregate concrete specimens,the mesostructural model of light aggregate concrete with real aggregate characteristics is established.The numerical simulation of uniaxial tensile test,uniaxial compression test and three-point bending test of lightweight aggregate concrete are carried out using a new finite element method-the base force element method respectively.Firstly,the image processing technology is used to produce beam specimens,uniaxial compression specimens and uniaxial tensile specimens of light aggregate concrete,which can better simulate the aggregate shape and random distribution of real light aggregate concrete.Secondly,the three-point bending test is numerically simulated.Thirdly,the uniaxial compression specimen generated by image processing technology is numerically simulated.Fourth,the uniaxial tensile specimen generated by image processing technology is numerically simulated.The mechanical behavior and damage mode of the specimen during loading were analyzed.The results of numerical simulation are compared and analyzed with those of relevant experiments.The feasibility and correctness of the micromodel established in this study for analyzing the micromechanics of lightweight aggregate concrete materials are verified.Image processing technology has a broad application prospect in the field of concrete mesoscopic damage analysis.展开更多
In this reported study, the density functional theory(DFT) was used at the(U)B3LYP/6-311G(d,p) level to investigate the stabilization process of the nitrate ester plasticized polyether propellant(NEPE). Molecular simu...In this reported study, the density functional theory(DFT) was used at the(U)B3LYP/6-311G(d,p) level to investigate the stabilization process of the nitrate ester plasticized polyether propellant(NEPE). Molecular simulations were conducted of the reaction that generates NO_(2), the autocatalytic and aging reaction triggered by the NO_(2), and the nitrogen dioxide absorption reaction of the stabilizers during the propellent stabilization process. These simulations were derived using the transition-state theory(TST)and variational transition-state theory(VTST). The simulation results suggested that the stabilization of the NEPE propellant consisted of three stages. First, heat and NO_(2) were generated during the denitrification reaction of nitroglycerine(NG) and 1,2,4-butanetriol trinitrate(BTTN) in the NEPE propellant.Second, nitroso products were generated by the reactions of N-Methyl-4-nitroaniline(MNA) and 2-nitrodiphenylamine(2NDPA) with NO_(2). Third, the stabilizers were exhausted and the autocatalytic reaction of NG and BTTN and the aging reaction of polyethylene glycol(PEG) were triggered by the heat and NO_(2)generated in the first stage. By comparing the energy barriers of the various reactions, it was found that the NO_(2)generated from the denitrification reaction significantly reduced the reaction energy barrier to 105.56-126.32 kJ/mol, also increased the reaction rate constant, and decreased the thermal stability and energetic properties of the NEPE propellant. In addition, the NO_(2)also weakened the mechanical properties of the NEPE propellant by attacking the-CH2groups and the O atoms in the PEG molecular chain. The energy barriers of the reactions of MNA and 2NDPA with NO_(2)(94.61-133.61 k J/mol) were lower than those of the autocatalytic and decomposition reactions of NG, BTTN, and the aging reactions of PEG(160.30-279.46 kJ/mol). This indicated that, by eliminating NO_(2), the stabilizer in the NEPE propellant can effectively prevent NO_(2)from reacting with the NG, BTTN, and PEG in the NEPE propellant. Consequently, this would help maintain the energy and mechanical properties of the NEPE propellant, thereby improving its thermal stability.展开更多
The geometry of joints has a significant influence on the mechanical properties of rocks.To simplify the curved joint shapes in rocks,the joint shape is usually treated as straight lines or planes in most laboratory e...The geometry of joints has a significant influence on the mechanical properties of rocks.To simplify the curved joint shapes in rocks,the joint shape is usually treated as straight lines or planes in most laboratory experiments and numerical simulations.In this study,the computerized tomography (CT) scanning and photogrammetry were employed to obtain the internal and surface joint structures of a limestone sample,respectively.To describe the joint geometry,the edge detection algorithms and a three-dimensional (3D) matrix mapping method were applied to reconstruct CT-based and photogrammetry-based jointed rock models.For comparison tests,the numerical uniaxial compression tests were conducted on an intact rock sample and a sample with a joint simplified to a plane using the parallel computing method.The results indicate that the mechanical characteristics and failure process of jointed rocks are significantly affected by the geometry of joints.The presence of joints reduces the uniaxial compressive strength (UCS),elastic modulus,and released acoustic emission (AE) energy of rocks by 37%–67%,21%–24%,and 52%–90%,respectively.Compared to the simplified joint sample,the proposed photogrammetry-based numerical model makes the most of the limited geometry information of joints.The UCS,accumulative released AE energy,and elastic modulus of the photogrammetry-based sample were found to be very close to those of the CT-based sample.The UCS value of the simplified joint sample (i.e.38.5 MPa) is much lower than that of the CT-based sample (i.e.72.3 MPa).Additionally,the accumulative released AE energy observed in the simplified joint sample is 3.899 times lower than that observed in the CT-based sample.CT scanning provides a reliable means to visualize the joints in rocks,which can be used to verify the reliability of photogrammetry techniques.The application of the photogrammetry-based sample enables detailed analysis for estimating the mechanical properties of jointed rocks.展开更多
Background Most existing chemical experiment teaching systems lack solid immersive experiences,making it difficult to engage students.To address these challenges,we propose a chemical simulation teaching system based ...Background Most existing chemical experiment teaching systems lack solid immersive experiences,making it difficult to engage students.To address these challenges,we propose a chemical simulation teaching system based on virtual reality and gesture interaction.Methods The parameters of the models were obtained through actual investigation,whereby Blender and 3DS MAX were used to model and import these parameters into a physics engine.By establishing an interface for the physics engine,gesture interaction hardware,and virtual reality(VR)helmet,a highly realistic chemical experiment environment was created.Using code script logic,particle systems,as well as other systems,chemical phenomena were simulated.Furthermore,we created an online teaching platform using streaming media and databases to address the problems of distance teaching.Results The proposed system was evaluated against two mainstream products in the market.In the experiments,the proposed system outperformed the other products in terms of fidelity and practicality.Conclusions The proposed system which offers realistic simulations and practicability,can help improve the high school chemistry experimental education.展开更多
Numerical simulation is the most powerful computational and analysis tool for a large variety of engineering and physical problems.For a complex problem relating to multi-field,multi-process and multi-scale,different ...Numerical simulation is the most powerful computational and analysis tool for a large variety of engineering and physical problems.For a complex problem relating to multi-field,multi-process and multi-scale,different computing tools have to be developed so as to solve particular fields at different scales and for different processes.Therefore,the integration of different types of software is inevitable.However,it is difficult to perform the transfer of the meshes and simulated results among software packages because of the lack of shared data formats or encrypted data formats.An image processing based method for three-dimensional model reconstruction for numerical simulation was proposed,which presents a solution to the integration problem by a series of slice or projection images obtained by the post-processing modules of the numerical simulation software.By means of mapping image pixels to meshes of either finite difference or finite element models,the geometry contour can be extracted to export the stereolithography model.The values of results,represented by color,can be deduced and assigned to the meshes.All the models with data can be directly or indirectly integrated into other software as a continued or new numerical simulation.The three-dimensional reconstruction method has been validated in numerical simulation of castings and case studies were provided in this study.展开更多
Lunar surface additive manufacturing with lunar regolith is a key step in in-situ resource utilization.The powder spreading process is the key process,which has a major impact on the quality of the powder bed and the ...Lunar surface additive manufacturing with lunar regolith is a key step in in-situ resource utilization.The powder spreading process is the key process,which has a major impact on the quality of the powder bed and the precision of molded parts.In this study,the discrete element method(DEM)was adopted to simulate the powder spreading process with a roller.The three powder bed quality indicators,including the molding layer offset,voidage fraction,and surface roughness,were established.Besides,the influence of the three process parameters,which are roller’s translational speed,rotational speed,and powder spreading layer thickness on the powder bed quality indicators was also analyzed.The results show that with the reduction of the powder spreading layer thickness and the increase of the rotational speed,the offset increased significantly;when the translational speed increased,the offset first increased and then decreased,which resulted in an extreme value;with the increase of the layer thickness and the decrease of the translational speed,the values for voidage fraction and surface roughness significantly reduced.The powder bed quality indicators were adopted as the optimization objective,and the multi-objective parameter optimization was carried out.The predicted optimal powder spreading parameters and powder bed quality indicators were then obtained.Moreover,the optimal values were then verified.This study can provide informative guidance for in-situ manufacturing at the moon in future deep space exploration missions.展开更多
The aim of this study was to simulate the solidification process of beam blank continuous casting, and then find the reasons for the typical defects of the beam blank. A two-dimensional transient coupled finite elemen...The aim of this study was to simulate the solidification process of beam blank continuous casting, and then find the reasons for the typical defects of the beam blank. A two-dimensional transient coupled finite element model has been developed to compute the temperature and stress profile in beam blank continuous casting. The enthalpy method was used in the heat conduction equation. The thermo-mechanical property in the mushy zone was taken into consideration in this calculation. It is shown that at the mold exit the thickness of the shell had its maximum value at the flange tip and its minimum value at the fillet. The temperature had a great fluctuation on the surface of the beam blank in the secondary cooling zone. At the unbending point, the surface temperature of the web was in the brittleness temperature range under the present condition. To ensure the quality, it is necessary to weaken the intensity of secondary cooling. At the mold exit the equivalent stress and strain have higher values at the flange tip and at the web. From the spray 1 to the unbending point, the maximum values of stress and strain gradually moved to the internal section of the flange tip and the web. However, whenever, there were bigger stress and strain values near the flange tip and the web than in the other parts, it must be very easy to generate cracks at those positions. Now, online verification of this simulation has been developed, which has proved to be very useful and efficient to instruct the practical production of beam blank continuous casting.展开更多
A molecular dynamics simulation study has been performed for the microstructure evolution in a liquid metal Ni system during crystallization process at two cooling rates by adopting the embedded atom method (EAM) mo...A molecular dynamics simulation study has been performed for the microstructure evolution in a liquid metal Ni system during crystallization process at two cooling rates by adopting the embedded atom method (EAM) model potential. The bond-type index method of Honeycutt-Andersen (HA) and a new cluster-type index method (CTIM-2) have been used to detect and analyse the microstructures in this system. It is demonstrated that the cooling rate plays a critical role in the microstructure evolution: below the crystallization temperature Tc, the effects of cooling rate are very remarkable and can be fully displayed. At different cooling rates of 2.0 × 10^13 K·s^-1 and 1.0 × 10^12 K·s^-1, two different kinds of crystal structures are obtained in the system. The first one is the coexistence of the hcp (expressed by (12 0 0 0 6 6) in CTIM-2) and the fcc (12 0 0 0 12 0) basic clusters consisting of 1421 and 1422 bond-types, and the hcp basic cluster becomes the dominant one with decreasing temperature, the second one is mainly the fcc (12 0 0 0 12 0) basic clusters consisting of 1421 bond-type, and their crystallization temperatures Tc would be 1073 and 1173 K, respectively.展开更多
The western coast of Hainan Island exhibits a savanna landscape. Many types of sand dunes, including transverse dune ridges, longitudinal dune ridges, elliptical dunes, coppice dunes, and climbing dunes, are widely di...The western coast of Hainan Island exhibits a savanna landscape. Many types of sand dunes, including transverse dune ridges, longitudinal dune ridges, elliptical dunes, coppice dunes, and climbing dunes, are widely distributed in the coastal zone. In winter, high-frequency and high-energy NE winds (dominant winds) are prevalent, with a resultant drift direction (RDD) of S35.6°W. In spring, low-frequency and low-energy SW secondary winds prevail, with a RDD of N25.1°E. Wind tunnel simulations revealed that the airflow over the dune surface is the main factor controlling the erosion and deposition patterns of dune surfaces and the morphological development of dunes. In the region's bidirectional wind environment, with two seasonally distinct energy levels, the airflow over the surface of elliptical dunes, barchan dunes, and transverse dune ridges will exhibit a transverse pattern, whereas the airflow over longitudinal dunes ridges exhibits a lateral pattern and that over climbing dunes exhibits a climbing-circumfluent pattern. These patterns represent different dynamic processes. The coastal dunes on the western coast of Hainan Island are influenced by factors such as onshore winds, sand sources, coastal slopes, rivers, and forest shelter belts. The source of the sand that supplements these dunes particularly influences the development pattern: when there is more sand, the pattern shows positive equilibrium deposition between dune ridges and dunes; otherwise, it shows negative equilibrium deposition. The presence or absence of forest shelter belts also influences deposition and dune development patterns and transformation of dune forms. Coastal dunes and inland desert dunes experience similar dynamic processes, but the former have more diversified shapes and more complex formation mechanisms.展开更多
Turbidity currents represent a major agent for sediment transport in lakes, seas and oceans. In particu-lar, they formulate the most significant clastic accumulations in the deep sea, which become many of the world's...Turbidity currents represent a major agent for sediment transport in lakes, seas and oceans. In particu-lar, they formulate the most significant clastic accumulations in the deep sea, which become many of the world's most important hydrocarbon reservoirs. Several boreholes in the Qiongdongnan Basin, the north-western South China Sea, have recently revealed turbidity current deposits as significant hydrocarbon res-ervoirs. However, there are some arguments for the potential provenances. To solve this problem, it is es-sential to delineate their sedimentary processes as well as to evaluate their qualities as reservoir. Numerical simulations have been developed rapidly over the last several years, offering insights into turbidity current behaviors, as geologically significant turbidity currents are difficult to directly investigate due to their large scale and often destructive nature. Combined with the interpretation of the turbidity system based on high-resolution 3D seismic data, the paleotophography is acquired via a back-stripping seismic profile integrated with a borehole, i.e., Well A, in the western Qiongdongnan Basin; then a numerical model is built on the basis of this back-stripped profile. After defining the various turbidity current initial boundary conditions, includ-ing grain size, velocity and sediment concentration, the structures and behaviors of turbidity currents are investigated via numerical simulation software ANSYS FLUENT. Finally, the simulated turbidity deposits are compared with the interpreted sedimentary bodies based on 3D seismic data and the potential provenances of the revealed turbidites by Well A are discussed in details. The simulation results indicate that a sedimen-tary body develops far away from its source with an average grain size of 0.1 mm, i.e., sand-size sediment. Taking into account the location and orientation of the simulated seismic line, the consistence between normal forward simulation results and the revealed cores in Well A indicates that the turbidites should have been transported from Vietnam instead of Hainan Island. This interpretation has also been verified by the planar maps of sedimentary systems based on integration of boreholes and seismic data. The identification of the turbidity provenance will benefit the evaluation of extensively distributed submarine fans for hydro-carbon exploration in the deepwater areas.展开更多
Numerical simulation of casting's mold filling process is the main and the most important aspect of the foundry CAE technology. But it is time-consuming; it may take dozens of hours or several days. While with the de...Numerical simulation of casting's mold filling process is the main and the most important aspect of the foundry CAE technology. But it is time-consuming; it may take dozens of hours or several days. While with the development of computer hardware, numerical simulation of casting' s mold filling process has made rapid progress. The simulation results, therefore, have become more and more practical. This study tries to find some clues of the computational time of mold filling process. Firstly, this paper introduces mathematic model and the basic route of numerical simulation of casting's mold filling process. Then the computational time of mold filling process has been carefully studied, and some new and useful results have been gained from the study of the computational time. Finally, this paper has given some real applications of numerical simulation of casting's mold filling process.展开更多
A 3-D mathematical model considering turbulence phenomena has been established based on a computational fluid dynamics technique, so called 3-D SOLA-VOF (Solution Algorithm-Volume of Fluid), to simulate the fluid flow...A 3-D mathematical model considering turbulence phenomena has been established based on a computational fluid dynamics technique, so called 3-D SOLA-VOF (Solution Algorithm-Volume of Fluid), to simulate the fluid flow of mold filling process of die casting. In addition, the mathematical model for simulating the heat transfer in die casting process has also been established. The computation program has been developed by the authors with the finite difference method (FDM) recently. As verification, the mold filling process of a S-shaped die casting has been simulated and the simulation results coincide with that of the benchmark test. Finally, as a practical application, the gating design of a motorcycle component was modified by the mold filling simulation and the dies design of another motorcycle component was optimized by the heat transfer simulation. All the optimized designs were verified by the production practice.展开更多
Large quantities of blast furnace(BF) slag and CO_2 are discharged annually from iron and steel industries, along with a large amount of waste heat.The mineral carbonation of BF slag can not only reduce emissions of s...Large quantities of blast furnace(BF) slag and CO_2 are discharged annually from iron and steel industries, along with a large amount of waste heat.The mineral carbonation of BF slag can not only reduce emissions of solid waste but also realize the in-situ fixation of CO_2 with low energy consumption if integrated with the waste heat utilization.In this study, based on our previous works, Aspen Plus was employed to simulate and optimize the carbonation process and integrate the process energy.The effects of gehlenite extraction, MgSO_4 carbonation,and aluminum ammonium sulfate crystallization were studied systematically.The simulation results demonstrate that 2.57 kg of BF slag can sequester 1 kg of CO_2, requiring 5.34 MJ of energy(3.3 MJ heat and 2.04 MJ electricity), and this energy includes the capture of CO_2 from industrial flue gases.Approximately 60 kg net CO_2 emission reduction could be achieved for the disposal of one ton of BF slag.In addition, the by-product,aluminum ammonium sulfate, is a high value-added product.Preliminary economic analysis indicates that the profit for the whole process is 1127 CNY per ton of BF slag processed.展开更多
In this paper,the process modeling and dynamic simulation for the EAST helium refrigerator has been completed.The cryogenic process model is described and the main components are customized in detail.The process model...In this paper,the process modeling and dynamic simulation for the EAST helium refrigerator has been completed.The cryogenic process model is described and the main components are customized in detail.The process model is controlled by the PLC simulator,and the realtime communication between the process model and the controllers is achieved by a customized interface.Validation of the process model has been confirmed based on EAST experimental data during the cool down process of 300-80 K.Simulation results indicate that this process simulator is able to reproduce dynamic behaviors of the EAST helium refrigerator very well for the operation of long pulsed plasma discharge.The cryogenic process simulator based on control architecture is available for operation optimization and control design of EAST cryogenic systems to cope with the long pulsed heat loads in the future.展开更多
Tube hydroforming process is a relative new process f or production of structural parts of low weight and high rigidity. The successfu lness of the process depends largely on the a proper selection of loading path w h...Tube hydroforming process is a relative new process f or production of structural parts of low weight and high rigidity. The successfu lness of the process depends largely on the a proper selection of loading path w hich is axial feeding distance as related to the applied internal pressure. Due to the complicated nature of plastic deformation, a optimum loading path which w ill guarantee good hydroformed parts free of winkle and fracture has often to be determined by finite element analysis. In order to save trials and errors, adap tive FEM simulation method has been developed. To effectively apply the adaptive simulation method, we have to know the applicability of the method. In this pap er, a classification of tube hydroforming (THF) processes based on sensitivity to loading parameters has been suggested. Characteristics of the classification have been analyzed in terms of failure mode, dominant loading parameters and th eir working windows. It was discussed that the so called pressure dominant THF p rocess is the most difficult process for both simulation in FEM analysis and pra ctical operation in real manufacturing situation. To effectively find out the op timum loading path for pressure dominant THF process, adaptive FEM simulation st rategies are mostly needed.展开更多
In order to investigate dynamic behaviors of a 500W@ 4.5K helium refrigerator,the process simulator has been completed. The cryogenic process model is described and main components are customized. The realtime communi...In order to investigate dynamic behaviors of a 500W@ 4.5K helium refrigerator,the process simulator has been completed. The cryogenic process model is described and main components are customized. The realtime communication between the process model and the control system has been achieved. Compared with the preliminary experimental data,the errors of temperatures during the process of 300 K-80 K are less than 10%.The process model is validated to predict the cool-down process very well. The controller parameters are tuned in simulation and applied to the actual refrigerator suitably. Based on the dynamic simulation,the operation of Joule-Thomson( JT) by pass valve has been optimized. And the cool- down process from 300 K to 4. 5 K has been simulated under the control programs. Simulation results indicate that this dynamic simulator based on actual control architecture is available to process control and operation optimization for the helium refrigerators.展开更多
基金supported by National Natural Sciences Foundation of China(No.62271165,62027802,62201307)the Guangdong Basic and Applied Basic Research Foundation(No.2023A1515030297)+2 种基金the Shenzhen Science and Technology Program ZDSYS20210623091808025Stable Support Plan Program GXWD20231129102638002the Major Key Project of PCL(No.PCL2024A01)。
文摘Due to the restricted satellite payloads in LEO mega-constellation networks(LMCNs),remote sensing image analysis,online learning and other big data services desirably need onboard distributed processing(OBDP).In existing technologies,the efficiency of big data applications(BDAs)in distributed systems hinges on the stable-state and low-latency links between worker nodes.However,LMCNs with high-dynamic nodes and long-distance links can not provide the above conditions,which makes the performance of OBDP hard to be intuitively measured.To bridge this gap,a multidimensional simulation platform is indispensable that can simulate the network environment of LMCNs and put BDAs in it for performance testing.Using STK's APIs and parallel computing framework,we achieve real-time simulation for thousands of satellite nodes,which are mapped as application nodes through software defined network(SDN)and container technologies.We elaborate the architecture and mechanism of the simulation platform,and take the Starlink and Hadoop as realistic examples for simulations.The results indicate that LMCNs have dynamic end-to-end latency which fluctuates periodically with the constellation movement.Compared to ground data center networks(GDCNs),LMCNs deteriorate the computing and storage job throughput,which can be alleviated by the utilization of erasure codes and data flow scheduling of worker nodes.
基金supported by the National Science Foundation of China(10972015,11172015)the Beijing Natural Science Foundation(8162008).
文摘The mechanical properties and failure mechanism of lightweight aggregate concrete(LWAC)is a hot topic in the engineering field,and the relationship between its microstructure and macroscopic mechanical properties is also a frontier research topic in the academic field.In this study,the image processing technology is used to establish a micro-structure model of lightweight aggregate concrete.Through the information extraction and processing of the section image of actual light aggregate concrete specimens,the mesostructural model of light aggregate concrete with real aggregate characteristics is established.The numerical simulation of uniaxial tensile test,uniaxial compression test and three-point bending test of lightweight aggregate concrete are carried out using a new finite element method-the base force element method respectively.Firstly,the image processing technology is used to produce beam specimens,uniaxial compression specimens and uniaxial tensile specimens of light aggregate concrete,which can better simulate the aggregate shape and random distribution of real light aggregate concrete.Secondly,the three-point bending test is numerically simulated.Thirdly,the uniaxial compression specimen generated by image processing technology is numerically simulated.Fourth,the uniaxial tensile specimen generated by image processing technology is numerically simulated.The mechanical behavior and damage mode of the specimen during loading were analyzed.The results of numerical simulation are compared and analyzed with those of relevant experiments.The feasibility and correctness of the micromodel established in this study for analyzing the micromechanics of lightweight aggregate concrete materials are verified.Image processing technology has a broad application prospect in the field of concrete mesoscopic damage analysis.
基金the support provided by the School of Physics and Optoelectronic Engineering of Ludong University。
文摘In this reported study, the density functional theory(DFT) was used at the(U)B3LYP/6-311G(d,p) level to investigate the stabilization process of the nitrate ester plasticized polyether propellant(NEPE). Molecular simulations were conducted of the reaction that generates NO_(2), the autocatalytic and aging reaction triggered by the NO_(2), and the nitrogen dioxide absorption reaction of the stabilizers during the propellent stabilization process. These simulations were derived using the transition-state theory(TST)and variational transition-state theory(VTST). The simulation results suggested that the stabilization of the NEPE propellant consisted of three stages. First, heat and NO_(2) were generated during the denitrification reaction of nitroglycerine(NG) and 1,2,4-butanetriol trinitrate(BTTN) in the NEPE propellant.Second, nitroso products were generated by the reactions of N-Methyl-4-nitroaniline(MNA) and 2-nitrodiphenylamine(2NDPA) with NO_(2). Third, the stabilizers were exhausted and the autocatalytic reaction of NG and BTTN and the aging reaction of polyethylene glycol(PEG) were triggered by the heat and NO_(2)generated in the first stage. By comparing the energy barriers of the various reactions, it was found that the NO_(2)generated from the denitrification reaction significantly reduced the reaction energy barrier to 105.56-126.32 kJ/mol, also increased the reaction rate constant, and decreased the thermal stability and energetic properties of the NEPE propellant. In addition, the NO_(2)also weakened the mechanical properties of the NEPE propellant by attacking the-CH2groups and the O atoms in the PEG molecular chain. The energy barriers of the reactions of MNA and 2NDPA with NO_(2)(94.61-133.61 k J/mol) were lower than those of the autocatalytic and decomposition reactions of NG, BTTN, and the aging reactions of PEG(160.30-279.46 kJ/mol). This indicated that, by eliminating NO_(2), the stabilizer in the NEPE propellant can effectively prevent NO_(2)from reacting with the NG, BTTN, and PEG in the NEPE propellant. Consequently, this would help maintain the energy and mechanical properties of the NEPE propellant, thereby improving its thermal stability.
基金supported by the National Natural Science Foundation of China(Grant Nos.42277150,41977219)Henan Provincial Science and Technology Research Project(Grant No.222102320271).
文摘The geometry of joints has a significant influence on the mechanical properties of rocks.To simplify the curved joint shapes in rocks,the joint shape is usually treated as straight lines or planes in most laboratory experiments and numerical simulations.In this study,the computerized tomography (CT) scanning and photogrammetry were employed to obtain the internal and surface joint structures of a limestone sample,respectively.To describe the joint geometry,the edge detection algorithms and a three-dimensional (3D) matrix mapping method were applied to reconstruct CT-based and photogrammetry-based jointed rock models.For comparison tests,the numerical uniaxial compression tests were conducted on an intact rock sample and a sample with a joint simplified to a plane using the parallel computing method.The results indicate that the mechanical characteristics and failure process of jointed rocks are significantly affected by the geometry of joints.The presence of joints reduces the uniaxial compressive strength (UCS),elastic modulus,and released acoustic emission (AE) energy of rocks by 37%–67%,21%–24%,and 52%–90%,respectively.Compared to the simplified joint sample,the proposed photogrammetry-based numerical model makes the most of the limited geometry information of joints.The UCS,accumulative released AE energy,and elastic modulus of the photogrammetry-based sample were found to be very close to those of the CT-based sample.The UCS value of the simplified joint sample (i.e.38.5 MPa) is much lower than that of the CT-based sample (i.e.72.3 MPa).Additionally,the accumulative released AE energy observed in the simplified joint sample is 3.899 times lower than that observed in the CT-based sample.CT scanning provides a reliable means to visualize the joints in rocks,which can be used to verify the reliability of photogrammetry techniques.The application of the photogrammetry-based sample enables detailed analysis for estimating the mechanical properties of jointed rocks.
基金National Innovation and Entrepreneurship Program for College Students(202218213001)Science and Technology Innovation Strategy of Guangdong Province(Science and Technology Innovation Cultivation of University Students 2020329182130C000002).
文摘Background Most existing chemical experiment teaching systems lack solid immersive experiences,making it difficult to engage students.To address these challenges,we propose a chemical simulation teaching system based on virtual reality and gesture interaction.Methods The parameters of the models were obtained through actual investigation,whereby Blender and 3DS MAX were used to model and import these parameters into a physics engine.By establishing an interface for the physics engine,gesture interaction hardware,and virtual reality(VR)helmet,a highly realistic chemical experiment environment was created.Using code script logic,particle systems,as well as other systems,chemical phenomena were simulated.Furthermore,we created an online teaching platform using streaming media and databases to address the problems of distance teaching.Results The proposed system was evaluated against two mainstream products in the market.In the experiments,the proposed system outperformed the other products in terms of fidelity and practicality.Conclusions The proposed system which offers realistic simulations and practicability,can help improve the high school chemistry experimental education.
基金funded by National Key R&D Program of China(No.2021YFB3401200)the National Natural Science Foundation of China(No.51875308)the Beijing Nature Sciences Fund-Haidian Originality Cooperation Project(L212002).
文摘Numerical simulation is the most powerful computational and analysis tool for a large variety of engineering and physical problems.For a complex problem relating to multi-field,multi-process and multi-scale,different computing tools have to be developed so as to solve particular fields at different scales and for different processes.Therefore,the integration of different types of software is inevitable.However,it is difficult to perform the transfer of the meshes and simulated results among software packages because of the lack of shared data formats or encrypted data formats.An image processing based method for three-dimensional model reconstruction for numerical simulation was proposed,which presents a solution to the integration problem by a series of slice or projection images obtained by the post-processing modules of the numerical simulation software.By means of mapping image pixels to meshes of either finite difference or finite element models,the geometry contour can be extracted to export the stereolithography model.The values of results,represented by color,can be deduced and assigned to the meshes.All the models with data can be directly or indirectly integrated into other software as a continued or new numerical simulation.The three-dimensional reconstruction method has been validated in numerical simulation of castings and case studies were provided in this study.
文摘Lunar surface additive manufacturing with lunar regolith is a key step in in-situ resource utilization.The powder spreading process is the key process,which has a major impact on the quality of the powder bed and the precision of molded parts.In this study,the discrete element method(DEM)was adopted to simulate the powder spreading process with a roller.The three powder bed quality indicators,including the molding layer offset,voidage fraction,and surface roughness,were established.Besides,the influence of the three process parameters,which are roller’s translational speed,rotational speed,and powder spreading layer thickness on the powder bed quality indicators was also analyzed.The results show that with the reduction of the powder spreading layer thickness and the increase of the rotational speed,the offset increased significantly;when the translational speed increased,the offset first increased and then decreased,which resulted in an extreme value;with the increase of the layer thickness and the decrease of the translational speed,the values for voidage fraction and surface roughness significantly reduced.The powder bed quality indicators were adopted as the optimization objective,and the multi-objective parameter optimization was carried out.The predicted optimal powder spreading parameters and powder bed quality indicators were then obtained.Moreover,the optimal values were then verified.This study can provide informative guidance for in-situ manufacturing at the moon in future deep space exploration missions.
基金supported by the Hebei Provincial Natural Science Foundation of China(No.E2007000591).
文摘The aim of this study was to simulate the solidification process of beam blank continuous casting, and then find the reasons for the typical defects of the beam blank. A two-dimensional transient coupled finite element model has been developed to compute the temperature and stress profile in beam blank continuous casting. The enthalpy method was used in the heat conduction equation. The thermo-mechanical property in the mushy zone was taken into consideration in this calculation. It is shown that at the mold exit the thickness of the shell had its maximum value at the flange tip and its minimum value at the fillet. The temperature had a great fluctuation on the surface of the beam blank in the secondary cooling zone. At the unbending point, the surface temperature of the web was in the brittleness temperature range under the present condition. To ensure the quality, it is necessary to weaken the intensity of secondary cooling. At the mold exit the equivalent stress and strain have higher values at the flange tip and at the web. From the spray 1 to the unbending point, the maximum values of stress and strain gradually moved to the internal section of the flange tip and the web. However, whenever, there were bigger stress and strain values near the flange tip and the web than in the other parts, it must be very easy to generate cracks at those positions. Now, online verification of this simulation has been developed, which has proved to be very useful and efficient to instruct the practical production of beam blank continuous casting.
基金Project supported by the National Natural Science Foundation of China (Grant Nos 50271026 and 50571037).
文摘A molecular dynamics simulation study has been performed for the microstructure evolution in a liquid metal Ni system during crystallization process at two cooling rates by adopting the embedded atom method (EAM) model potential. The bond-type index method of Honeycutt-Andersen (HA) and a new cluster-type index method (CTIM-2) have been used to detect and analyse the microstructures in this system. It is demonstrated that the cooling rate plays a critical role in the microstructure evolution: below the crystallization temperature Tc, the effects of cooling rate are very remarkable and can be fully displayed. At different cooling rates of 2.0 × 10^13 K·s^-1 and 1.0 × 10^12 K·s^-1, two different kinds of crystal structures are obtained in the system. The first one is the coexistence of the hcp (expressed by (12 0 0 0 6 6) in CTIM-2) and the fcc (12 0 0 0 12 0) basic clusters consisting of 1421 and 1422 bond-types, and the hcp basic cluster becomes the dominant one with decreasing temperature, the second one is mainly the fcc (12 0 0 0 12 0) basic clusters consisting of 1421 bond-type, and their crystallization temperatures Tc would be 1073 and 1173 K, respectively.
基金National Natural Science Foundation of China, No.40671186 No.40271012
文摘The western coast of Hainan Island exhibits a savanna landscape. Many types of sand dunes, including transverse dune ridges, longitudinal dune ridges, elliptical dunes, coppice dunes, and climbing dunes, are widely distributed in the coastal zone. In winter, high-frequency and high-energy NE winds (dominant winds) are prevalent, with a resultant drift direction (RDD) of S35.6°W. In spring, low-frequency and low-energy SW secondary winds prevail, with a RDD of N25.1°E. Wind tunnel simulations revealed that the airflow over the dune surface is the main factor controlling the erosion and deposition patterns of dune surfaces and the morphological development of dunes. In the region's bidirectional wind environment, with two seasonally distinct energy levels, the airflow over the surface of elliptical dunes, barchan dunes, and transverse dune ridges will exhibit a transverse pattern, whereas the airflow over longitudinal dunes ridges exhibits a lateral pattern and that over climbing dunes exhibits a climbing-circumfluent pattern. These patterns represent different dynamic processes. The coastal dunes on the western coast of Hainan Island are influenced by factors such as onshore winds, sand sources, coastal slopes, rivers, and forest shelter belts. The source of the sand that supplements these dunes particularly influences the development pattern: when there is more sand, the pattern shows positive equilibrium deposition between dune ridges and dunes; otherwise, it shows negative equilibrium deposition. The presence or absence of forest shelter belts also influences deposition and dune development patterns and transformation of dune forms. Coastal dunes and inland desert dunes experience similar dynamic processes, but the former have more diversified shapes and more complex formation mechanisms.
基金The National Science and Technology Major Project of China under contract No.2011ZX05025-002-02the National Natural Science Foundation of China under contract Nos 41476032,91028009 and 40806019
文摘Turbidity currents represent a major agent for sediment transport in lakes, seas and oceans. In particu-lar, they formulate the most significant clastic accumulations in the deep sea, which become many of the world's most important hydrocarbon reservoirs. Several boreholes in the Qiongdongnan Basin, the north-western South China Sea, have recently revealed turbidity current deposits as significant hydrocarbon res-ervoirs. However, there are some arguments for the potential provenances. To solve this problem, it is es-sential to delineate their sedimentary processes as well as to evaluate their qualities as reservoir. Numerical simulations have been developed rapidly over the last several years, offering insights into turbidity current behaviors, as geologically significant turbidity currents are difficult to directly investigate due to their large scale and often destructive nature. Combined with the interpretation of the turbidity system based on high-resolution 3D seismic data, the paleotophography is acquired via a back-stripping seismic profile integrated with a borehole, i.e., Well A, in the western Qiongdongnan Basin; then a numerical model is built on the basis of this back-stripped profile. After defining the various turbidity current initial boundary conditions, includ-ing grain size, velocity and sediment concentration, the structures and behaviors of turbidity currents are investigated via numerical simulation software ANSYS FLUENT. Finally, the simulated turbidity deposits are compared with the interpreted sedimentary bodies based on 3D seismic data and the potential provenances of the revealed turbidites by Well A are discussed in details. The simulation results indicate that a sedimen-tary body develops far away from its source with an average grain size of 0.1 mm, i.e., sand-size sediment. Taking into account the location and orientation of the simulated seismic line, the consistence between normal forward simulation results and the revealed cores in Well A indicates that the turbidites should have been transported from Vietnam instead of Hainan Island. This interpretation has also been verified by the planar maps of sedimentary systems based on integration of boreholes and seismic data. The identification of the turbidity provenance will benefit the evaluation of extensively distributed submarine fans for hydro-carbon exploration in the deepwater areas.
文摘Numerical simulation of casting's mold filling process is the main and the most important aspect of the foundry CAE technology. But it is time-consuming; it may take dozens of hours or several days. While with the development of computer hardware, numerical simulation of casting' s mold filling process has made rapid progress. The simulation results, therefore, have become more and more practical. This study tries to find some clues of the computational time of mold filling process. Firstly, this paper introduces mathematic model and the basic route of numerical simulation of casting's mold filling process. Then the computational time of mold filling process has been carefully studied, and some new and useful results have been gained from the study of the computational time. Finally, this paper has given some real applications of numerical simulation of casting's mold filling process.
文摘A 3-D mathematical model considering turbulence phenomena has been established based on a computational fluid dynamics technique, so called 3-D SOLA-VOF (Solution Algorithm-Volume of Fluid), to simulate the fluid flow of mold filling process of die casting. In addition, the mathematical model for simulating the heat transfer in die casting process has also been established. The computation program has been developed by the authors with the finite difference method (FDM) recently. As verification, the mold filling process of a S-shaped die casting has been simulated and the simulation results coincide with that of the benchmark test. Finally, as a practical application, the gating design of a motorcycle component was modified by the mold filling simulation and the dies design of another motorcycle component was optimized by the heat transfer simulation. All the optimized designs were verified by the production practice.
基金Supported by the National Key Projects for Fundamental Research and Development of China(2016YFB0600904)
文摘Large quantities of blast furnace(BF) slag and CO_2 are discharged annually from iron and steel industries, along with a large amount of waste heat.The mineral carbonation of BF slag can not only reduce emissions of solid waste but also realize the in-situ fixation of CO_2 with low energy consumption if integrated with the waste heat utilization.In this study, based on our previous works, Aspen Plus was employed to simulate and optimize the carbonation process and integrate the process energy.The effects of gehlenite extraction, MgSO_4 carbonation,and aluminum ammonium sulfate crystallization were studied systematically.The simulation results demonstrate that 2.57 kg of BF slag can sequester 1 kg of CO_2, requiring 5.34 MJ of energy(3.3 MJ heat and 2.04 MJ electricity), and this energy includes the capture of CO_2 from industrial flue gases.Approximately 60 kg net CO_2 emission reduction could be achieved for the disposal of one ton of BF slag.In addition, the by-product,aluminum ammonium sulfate, is a high value-added product.Preliminary economic analysis indicates that the profit for the whole process is 1127 CNY per ton of BF slag processed.
基金supported by National Natural Science Foundation of China(No.51306195)Key Laboratory of Cryogenics,Technical Institute of Physics and Chemistry,CAS(No.CRYO201408)
文摘In this paper,the process modeling and dynamic simulation for the EAST helium refrigerator has been completed.The cryogenic process model is described and the main components are customized in detail.The process model is controlled by the PLC simulator,and the realtime communication between the process model and the controllers is achieved by a customized interface.Validation of the process model has been confirmed based on EAST experimental data during the cool down process of 300-80 K.Simulation results indicate that this process simulator is able to reproduce dynamic behaviors of the EAST helium refrigerator very well for the operation of long pulsed plasma discharge.The cryogenic process simulator based on control architecture is available for operation optimization and control design of EAST cryogenic systems to cope with the long pulsed heat loads in the future.
文摘Tube hydroforming process is a relative new process f or production of structural parts of low weight and high rigidity. The successfu lness of the process depends largely on the a proper selection of loading path w hich is axial feeding distance as related to the applied internal pressure. Due to the complicated nature of plastic deformation, a optimum loading path which w ill guarantee good hydroformed parts free of winkle and fracture has often to be determined by finite element analysis. In order to save trials and errors, adap tive FEM simulation method has been developed. To effectively apply the adaptive simulation method, we have to know the applicability of the method. In this pap er, a classification of tube hydroforming (THF) processes based on sensitivity to loading parameters has been suggested. Characteristics of the classification have been analyzed in terms of failure mode, dominant loading parameters and th eir working windows. It was discussed that the so called pressure dominant THF p rocess is the most difficult process for both simulation in FEM analysis and pra ctical operation in real manufacturing situation. To effectively find out the op timum loading path for pressure dominant THF process, adaptive FEM simulation st rategies are mostly needed.
基金Sponsored by the National Natural Science Foundation of China(Grant No.51306195)the Special Foundation of President of Hefei Institutes of Physical Science,Chinese Academy of Sciences(Grant No.YZJJ201308)the Application&Development Project of the Institute of Plasma Physics(Grant No.Y35ETY130G)
文摘In order to investigate dynamic behaviors of a 500W@ 4.5K helium refrigerator,the process simulator has been completed. The cryogenic process model is described and main components are customized. The realtime communication between the process model and the control system has been achieved. Compared with the preliminary experimental data,the errors of temperatures during the process of 300 K-80 K are less than 10%.The process model is validated to predict the cool-down process very well. The controller parameters are tuned in simulation and applied to the actual refrigerator suitably. Based on the dynamic simulation,the operation of Joule-Thomson( JT) by pass valve has been optimized. And the cool- down process from 300 K to 4. 5 K has been simulated under the control programs. Simulation results indicate that this dynamic simulator based on actual control architecture is available to process control and operation optimization for the helium refrigerators.