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Multi-objective optimization of the cathode catalyst layer micro-composition of polymer electrolyte membrane fuel cells using a multi-scale,two-phase fuel cell model and data-driven surrogates 被引量:2
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作者 Neil Vaz Jaeyoo Choi +3 位作者 Yohan Cha Jihoon Kong Yooseong Park Hyunchul Ju 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2023年第6期28-41,I0003,共15页
Polymer electrolyte membrane fuel cells(PEMFCs)are considered a promising alternative to internal combustion engines in the automotive sector.Their commercialization is mainly hindered due to the cost and effectivenes... Polymer electrolyte membrane fuel cells(PEMFCs)are considered a promising alternative to internal combustion engines in the automotive sector.Their commercialization is mainly hindered due to the cost and effectiveness of using platinum(Pt)in them.The cathode catalyst layer(CL)is considered a core component in PEMFCs,and its composition often considerably affects the cell performance(V_(cell))also PEMFC fabrication and production(C_(stack))costs.In this study,a data-driven multi-objective optimization analysis is conducted to effectively evaluate the effects of various cathode CL compositions on Vcelland Cstack.Four essential cathode CL parameters,i.e.,platinum loading(L_(Pt)),weight ratio of ionomer to carbon(wt_(I/C)),weight ratio of Pt to carbon(wt_(Pt/c)),and porosity of cathode CL(ε_(cCL)),are considered as the design variables.The simulation results of a three-dimensional,multi-scale,two-phase comprehensive PEMFC model are used to train and test two famous surrogates:multi-layer perceptron(MLP)and response surface analysis(RSA).Their accuracies are verified using root mean square error and adjusted R^(2).MLP which outperforms RSA in terms of prediction capability is then linked to a multi-objective non-dominated sorting genetic algorithmⅡ.Compared to a typical PEMFC stack,the results of the optimal study show that the single-cell voltage,Vcellis improved by 28 m V for the same stack price and the stack cost evaluated through the U.S department of energy cost model is reduced by$5.86/k W for the same stack performance. 展开更多
关键词 Polymer electrolyte membrane fuel cell Surrogate modeling Multi-layer perceptron(MLP) Response surface analysis(RSA) Non-dominated sorting genetic algorithmⅡ(NSGAⅡ)
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Is hepatitis B-virucidal validation of biocides possible with the use of surrogates?
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作者 Andreas Sauerbrei 《World Journal of Gastroenterology》 SCIE CAS 2014年第2期436-444,共9页
The hepatitis B virus(HBV)is considered to be a major public health problem worldwide,and a significant number of reports on nosocomial outbreaks of HBV infections have been reported.Prevention of indirect HBV transmi... The hepatitis B virus(HBV)is considered to be a major public health problem worldwide,and a significant number of reports on nosocomial outbreaks of HBV infections have been reported.Prevention of indirect HBV transmission by contaminated objects is only possible through the use of infection-control principles,including the use of chemical biocides,which are proven to render the virus non-infectious.The virucidal activity of biocides against HBV cannot be predicted;therefore,validation of the virucidal action of disinfectants against HBV is essential.However,feasible HBV infectivity assays have not yet been established.Thus,surrogate models have been proposed for testing the efficacy of biocides against HBV.Most of these assays do not correlate with HBV infectivity.Currently,the most promising and feasible assay is the use of the taxonomically related duck hepatitis B virus(DHBV),which belongs to the same Hepadnaviridae virus family.This paper reviews the application of DHBV,which can be propagated in vitro in primary duck embryonic hepatocytes,for the testing of biocides and describes why this model can be used as reliable method to evaluate disinfectants for efficacy against HBV.The susceptibility levels of important biocides,which are often used as ingredients for commercially available disinfectants,are also described. 展开更多
关键词 Hepatitis B virus Surrogate model Duck hepatitis B virus DISINFECTANTS Testing virucidal efficacy
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Blastocyst-like embryo surrogates from stem cells in implantation models
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作者 Siyu Tian Hanzhang Ruan +1 位作者 William Shu-Biu Yeung Yin Lau Lee 《Reproductive and Developmental Medicine》 CSCD 2022年第4期225-233,共9页
Successful embryo implantation requires highly coordinated maternal-embryo interactions.Implantation failure is a major factor contributing to infertility.However,the mechanism underlying implantation failure remains ... Successful embryo implantation requires highly coordinated maternal-embryo interactions.Implantation failure is a major factor contributing to infertility.However,the mechanism underlying implantation failure remains unclear.An improved understanding of the early implantation process not only improves the success rate of assisted reproductive treatments but also helps in studying the pathophysiology of reproductive disorders.Owing to ethical concerns,in vivo studies of human embryo implantation are not feasible.However,the results obtained from animal models cannot be directly applied to humans.Over the years,in vitro implantation models have been developed to investigate implantation mechanisms.In this review,we discuss the use of different models for generating embryo-like surrogates to study early embryo development and implantation in vitro,with a specific focus on stem cell-derived blastocyst-like embryo surrogates.There is no definitive evidence that the recently established embryo-like models re-capitulate all developmental events of human embryos during the peri-implantation stage.Regardless,stem cell-derived embryo surrogates are the most valuable tools for studying the mechanisms of early cell lineage differentiation and developmental failures during implantation. 展开更多
关键词 implantation models Stem cells Embryo surrogates ENDOMETRIUM Trophoblastic spheroid Blastoids
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Surrogate-Based Dimensional Optimization of a Polymeric Roller for Ore Belt Conveyors Considering Viscoelastic Effects
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作者 Rafiq Said Dias Jabour Marco Antonio Luersen Euclides Alexandre Bernardelli 《Computers, Materials & Continua》 2026年第3期603-623,共21页
The roller is one of the fundamental elements of ore belt conveyor systems since it supports,guides,and directs material on the belt.This component comprises a body(the external tube)that rotates around a fixed shaft ... The roller is one of the fundamental elements of ore belt conveyor systems since it supports,guides,and directs material on the belt.This component comprises a body(the external tube)that rotates around a fixed shaft supported by easels.The external tube and shaft of rollers used in ore conveyor belts are mostly made of steel,resulting in high mass,hindering maintenance and replacement.Aiming to achieve mass reduction,we conducted a structural optimization of a roller with a polymeric external tube(hereafter referred to as a polymeric roller),seeking the optimal values for two design parameters:the inner diameter of the external tube and the shaft diameter.The optimization was constrained by admissible values for maximum stress,maximum deflection and misalignment angle between the shaft and bearings.A finite element model was built in Ansys Workbench to obtain the structural response of the system.The roller considered is composed of an external tube made of high-density polyethylene(HDPE),bearing seats of polyamide 6(PA6),and a steel shaft.To characterize the polymeric materials(HDPE and PA6),stress relaxation tests were conducted,and the data on shear modulus variation over time were inserted into the model to calculate Prony series terms to account for viscoelastic effects.The roller optimization was performed using surrogate modeling based on radial basis functions,with the Globalized Bounded Nelder-Mead(GBNM)algorithm as the optimizer.Two optimization cases were conducted.In the first case,concerning the roller’s initial material settings,the designs found violated the constraints and could not reduce mass.In the second case,by using PA6 in both bearing seats and the tube,a design configuration was found that respected all constraints and reduced the roller mass by 15.5%,equivalent to 5.15 kg.This study is among the first to integrate experimentally obtained viscoelastic data into the surrogate-based optimization of polymeric rollers,combining methodological innovation with industrial relevance. 展开更多
关键词 Conveyor belt rollers structural optimization surrogate modelling VISCOELASTICITY
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A Boundary Element Reconstruction (BER) Model for Moving Morphable Component Topology Optimization
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作者 Zhao Li Hongyu Xu +2 位作者 Shuai Zhang Jintao Cui Xiaofeng Liu 《Computers, Materials & Continua》 2026年第1期2213-2230,共18页
The moving morphable component(MMC)topology optimization method,as a typical explicit topology optimization method,has been widely concerned.In the MMC topology optimization framework,the surrogate material model is m... The moving morphable component(MMC)topology optimization method,as a typical explicit topology optimization method,has been widely concerned.In the MMC topology optimization framework,the surrogate material model is mainly used for finite element analysis at present,and the effectiveness of the surrogate material model has been fully confirmed.However,there are some accuracy problems when dealing with boundary elements using the surrogate material model,which will affect the topology optimization results.In this study,a boundary element reconstruction(BER)model is proposed based on the surrogate material model under the MMC topology optimization framework to improve the accuracy of topology optimization.The proposed BER model can reconstruct the boundary elements by refining the local meshes and obtaining new nodes in boundary elements.Then the density of boundary elements is recalculated using the new node information,which is more accurate than the original model.Based on the new density of boundary elements,the material properties and volume information of the boundary elements are updated.Compared with other finite element analysis methods,the BER model is simple and feasible and can improve computational accuracy.Finally,the effectiveness and superiority of the proposed method are verified by comparing it with the optimization results of the original surrogate material model through several numerical examples. 展开更多
关键词 Topology optimization MMC method boundary element reconstruction surrogate material model local mesh
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A relay-based probabilistic prediction model for multi-fidelity scenarios in total pressure loss of a compressor cascade with micro-textured surfaces
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作者 Liyue WANG Cong WANG +2 位作者 Xinyue LAN Haochen ZHANG Gang SUN 《Chinese Journal of Aeronautics》 2026年第1期55-65,共11页
The micro-riblet structures have been demonstrated effective in controlling the Total Pressure Loss(TPL)of aero-engine blades.However,due to the considerable scale gap between micro-texture and an actual aero-engine b... The micro-riblet structures have been demonstrated effective in controlling the Total Pressure Loss(TPL)of aero-engine blades.However,due to the considerable scale gap between micro-texture and an actual aero-engine blade,wind tunnel tests and numerical simulations with massive grids directly describing the global flow field are costly for aerodynamic evaluation.Furthermore,the fine micro surface structure brings unavoidable manufacturing errors,and the probability prediction contributes to gaining the confidence interval of the results.Therefore,a novel relay-based probabilistic model for multi-fidelity scenarios in the TPL prediction of a compressor cascade with micro-riblet surfaces is proposed to trade off accuracy and efficiency.Combined with the low-fidelity flow data generated by an aerodynamic solution strategy using the boundary surrogate model and the high-fidelity flow data from the experiment,the relay-based modeling has been achieved through knowledge transferring,and the confidence interval can be provided by the Gaussian Process Regression(GPR)model.The TPL of compressor cascades with micro-riblet surfaces under different surface structures at March number Ma=0.64,0.74,0.84 have been evaluated using the Relay-Based Probabilistic(RBP)model.The results illustrate that the RBP model could provide higher accuracy than the Single-Fidelity-Data-Driven(SFDD)prediction model,which show the promising potential of multi-fidelity scenarios data fusion in the aerodynamic evaluation of multi-scale configurations. 展开更多
关键词 Knowledge transfer Micro-riblet Multi-fidelity surrogate Probability prediction model Total pressure loss
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Shape-preserving mesh deformation method of perforated surfaces and application to double-wall turbine blade leading edge
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作者 Zhenyuan ZHANG Honglin LI +3 位作者 Zhonghao TANG Yajie BAO Yujie ZHAO Lei LI 《Chinese Journal of Aeronautics》 2026年第1期313-332,共20页
A Hybrid Free-Form Deformation(HFFD)method is developed to improve shape preservation in mesh deformation for perforated surfaces,which traditional Free-Form Deformation(FFD)techniques struggle to handle effectively.T... A Hybrid Free-Form Deformation(HFFD)method is developed to improve shape preservation in mesh deformation for perforated surfaces,which traditional Free-Form Deformation(FFD)techniques struggle to handle effectively.The proposed method enables high-fidelity parameterized deformation for both flat and curved perforated surfaces while maintaining mesh quality with minimal geometric distortion.To evaluate its effectiveness,comparative studies between HFFD and conventional FFD methods are conducted,demonstrating superior performance in mesh quality and geometric fidelity.The HFFD-based framework is further applied to the Multidisciplinary Design Optimization(MDO)of a double-wall turbine blade leading edge.Results indicate an 11.6%increase in cooling efficiency and a 16.21%reduction in maximum stress.Additionally,compared to traditional geometry-based parameterization in MDO,the HFFD approach improves model processing efficiency by 84.15%and overall optimization efficiency by20.05%.These findings demonstrate HFFD's potential to significantly improve complex engineering design optimization by achieving precise shape preservation and improving computational efficiency. 展开更多
关键词 Double-wall turbine blade Free-form mesh deformation Multidisciplinary design optimization Parameterized mesh deformation Surrogate model
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An experimental study on spray auto-ignition of RP-3 jet fuel and its surrogates 被引量:5
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作者 Yaozong DUAN Wang LIU +1 位作者 Zhen HUANG Dong HAN 《Frontiers in Energy》 SCIE CSCD 2021年第2期396-404,共9页
Jet fuel is widely used in air transportation,and sometimes for special vehicles in ground transportation.In the latter case,fuel spray auto-ignition behavior is an important index for engine operation reliability.Sur... Jet fuel is widely used in air transportation,and sometimes for special vehicles in ground transportation.In the latter case,fuel spray auto-ignition behavior is an important index for engine operation reliability.Surrogate fuel is usually used for fundamental combustion study due to the complex composition of practical fuels.As for jet fuels,two-component or three-component surrogate is usually selected to emulate practical fuels.The spray auto-ignition characteristics of RP-3 jet fuel and its three surrogates,the 70%mol n-decane/30%mol 1,2,4-trimethylbenzene blend(Surrogate 1),the 51%mol n-decane/49%mol 1,2,4-trimethylbenzene blend(Surrogate 2),and the 49.8%mol n-dodecane/21.6%mol iso-cetane/28.6%mol toluene blend(Surrogate 3)were studied in a heated constant volume combustion chamber.Surrogate 1 and Surrogate 2 possess the same components,but their blending percentages are different,as the two surrogates were designed to capture the H/C ratio(Surrogate 1)and DCN(Surrogate 2)of RP-3 jet fuel,respectively.Surrogate 3 could emulate more physiochemical properties of RP-3 jet fuel,including molecular weight,H/C ratio and DCN.Experimental results indicate that Surrogate 1 overestimates the auto-ignition propensity of RP-3 jet fuel,whereas Surrogates 2 and 3 show quite similar auto-ignition propensity with RP-3 jet fuel.Therefore,to capture the spray auto-ignition behaviors,DCN is the most important parameter to match when designing the surrogate formulation.However,as the ambient temperature changes,the surrogates matching DCN may still show some differences from the RP-3 jet fuel,e.g.,the first-stage heat release influenced by low-temperature chemistry. 展开更多
关键词 RP-3 jet fuel surrogate spray auto-ignition constant volume combustion chamber
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Active learning of deep surrogates for PDEs:application to metasurface design 被引量:4
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作者 Raphaël Pestourie Youssef Mroueh +2 位作者 Thanh V.Nguyen Payel Das Steven G.Johnson 《npj Computational Materials》 SCIE EI CSCD 2020年第1期312-318,共7页
Surrogate models for partial differential equations are widely used in the design of metamaterials to rapidly evaluate the behavior of composable components.However,the training cost of accurate surrogates by machine ... Surrogate models for partial differential equations are widely used in the design of metamaterials to rapidly evaluate the behavior of composable components.However,the training cost of accurate surrogates by machine learning can rapidly increase with the number of variables.For photonic-device models,we find that this training becomes especially challenging as design regions grow larger than the optical wavelength.We present an active-learning algorithm that reduces the number of simulations required by more than an order of magnitude for an NN surrogate model of optical-surface components compared to uniform random samples.Results show that the surrogate evaluation is over two orders of magnitude faster than a direct solve,and we demonstrate how this can be exploited to accelerate large-scale engineering optimization. 展开更多
关键词 OPTIMIZATION surrogate FASTER
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Higher taxa as surrogates of species richness of spiders in insect-resistant transgenic rice 被引量:1
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作者 Sheng Lin Min-Sheng You +3 位作者 Liette Vasseur Guang Yang Feng-Jing Liu Feng Guo 《Insect Science》 SCIE CAS CSCD 2012年第3期419-425,共7页
Biodiversity assessments can often be time- and resource-consuming. Several alternative approaches have been proposed to reduce sampling efforts, including indicator taxa and surrogates. In this study, we examine the ... Biodiversity assessments can often be time- and resource-consuming. Several alternative approaches have been proposed to reduce sampling efforts, including indicator taxa and surrogates. In this study, we examine the reliability of higher taxon surrogates to predict species richness in two experimental rice fields of Fujian Province, southeastern China during 2005 and 2009. Spider samples in transgenic and nontransgenie plots were collected using a suction sampler. Both the genus and family surrogates had significant and positive linear relationships with species richness in the transgenic and nontransgenic rice fields. The rice varieties did not significantly influence the linear relationships. Our findings suggest that higher-taxon surrogacy could be a useful alternative to complete species inventory for risk assessments of transgenic rice. 展开更多
关键词 ARANEAE biodiversity surrogate ecological risk assessment higher-taxonsurrogacy rapid biodiversity assessment taxonomic resolution
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Ecosystem classification and inventory maps as surrogates for ground beetle assemblages in boreal forest
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作者 J.A.Colin Bergeron F.Guillaume Blanchet +1 位作者 John R.Spence W.Jan A.Volney 《Journal of Plant Ecology》 SCIE 2012年第1期97-108,共12页
Aims We compare performance of ecosystem classification maps and provincial forest inventory data derived from air photography in reflecting ground beetle(Coleoptera:Carabidae)biodiversity patterns that are related to... Aims We compare performance of ecosystem classification maps and provincial forest inventory data derived from air photography in reflecting ground beetle(Coleoptera:Carabidae)biodiversity patterns that are related to the forest canopy mosaic.Our biodiversity surrogacy model based on remotely sensed tree canopy cover is validated against field-collected ground data.Methods We used a systematic sampling grid of 198 sites,covering 84 km^(2) of boreal mixedwood forest in northwestern Alberta,Canada.For every site,we determined tree basal area,characterized the ground beetle assemblage and obtained corresponding provincial forest inventory and ecosystem classification information.We used variation partitioning,ordination and misclassification matrices to compare beetle biodiversity patterns explained by alternative databases and to determine model biases originating from air photo-interpretation.Important Findings Ecosystem classification data performed better than canopy cover derived from forest inventory maps in describing ground beetle biodiversity patterns.The biodiversity surrogacy models based on provincial forest inventory maps and field survey generally detected similar patterns but inaccuracies in air photo-interpretation of relative canopy cover led to differences between the two models.Compared to field survey data,air photo-interpretation tended to confuse two Picea species and two Populus species present and homogenize stand mixtures.This generated divergence in models of ecological association used to predict the relationship between ground beetle assemblages and tree canopy cover.Combination of relative canopy cover from provincial inventory with other georeferenced land variables to produce the ecosystem classification maps improved biodiversity predictive power.The association observed between uncommon surrogates and uncommon ground beetle species emphasizes the benefits of detecting these surrogates as a part of landscape management.In order to complement conservation efforts established in protected areas,accurate,high resolution,wide ranging and spatially explicit knowledge of landscapes under management is primordial in order to apply effective biodiversity conservation strategies at the stand level as required in the extensively harvested portion of the boreal forest.In development of these strategies,an in-depth understanding of vegetation is key. 展开更多
关键词 biodiversity surrogate regional conservation forest inventory ecosystem classification CARABIDAE
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Deep convolutional surrogates and freedom in thermal design
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作者 Hadi Keramati Feridun Hamdullahpur 《Energy and AI》 2023年第3期126-136,共11页
A deep learning approach is presented for heat transfer and pressure drop prediction of complex fin geometries generated using composite Bézier curves.Thermal design process includes iterative high fidelity simul... A deep learning approach is presented for heat transfer and pressure drop prediction of complex fin geometries generated using composite Bézier curves.Thermal design process includes iterative high fidelity simulation which is complex,computationally expensive,and time-consuming.With the advancement in machine learning algorithms as well as Graphics Processing Units(GPUs),parallel processing architecture of GPUs can be used to accelerate thermo-fluid simulation.In this study,Convolutional Neural Networks(CNNs)are used to predict results of Computational Fluid Dynamics(CFD)directly from topologies saved as images.A design space with a single fin as well as multiple morphable fins are studied.A comparison of Xception network and regular CNN is presented for the case with a single fin design.Results show that high accuracy in prediction is observed for single fin design particularly using Xception network.Xception network provides 98 percent accuracy in heat transfer and pressure drop prediction of the single fin design.Increasing the design freedom to multiple fins increases the error in prediction.This error,however,remains within three percent of the ground truth values which is valuable for design purpose.The presented predictive model can be used for innovative BREP-based fin design optimization in compact and high efficiency heat exchangers. 展开更多
关键词 Geometric deep learning Geometry processing Heat exchanger Design freedom Surrogate modeling
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Study on correlation of thermal model to in-orbit data for infrared optical payloads on FY-3E/HIRAS-Ⅱ
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作者 LI Yu-Han YANG Bao-Yu +4 位作者 ZHANG Qiang GUO Zhi-Peng WU Yi-Nong TANG Xiao LI Shang-Ju 《红外与毫米波学报》 北大核心 2025年第3期394-405,共12页
The Infrared Hyperspectral Atmospheric SounderⅡ(HIRAS-Ⅱ)is the key equipment on FengYun-3E(FY-3E)satellite,which can realize vertical atmospheric detection,featuring hyper spectral,high sensitivity and high precisio... The Infrared Hyperspectral Atmospheric SounderⅡ(HIRAS-Ⅱ)is the key equipment on FengYun-3E(FY-3E)satellite,which can realize vertical atmospheric detection,featuring hyper spectral,high sensitivity and high precision.To ensure its accuracy of detection,it is necessary to correlate their thermal models to in-orbit da⁃ta.In this work,an investigation of intelligent correlation method named Intelligent Correlation Platform for Ther⁃mal Model(ICP-TM)was established,the advanced Kriging surrogate model and efficient adaptive region opti⁃mization algorithm were introduced.After the correlation with this method for FY-3E/HIRAS-Ⅱ,the results indi⁃cate that compared with the data in orbit,the error of the thermal model has decreased from 5 K to within±1 K in cold case(10℃).Then,the correlated model is validated in hot case(20℃),and the correlated model exhibits good universality.This correlation precision is also much superiors to the general ones like 3 K in other similar lit⁃erature.Furthermore,the process is finished in 8 days using ICP-TM,the efficiency is much better than 3 months based on manual.The results show that the proposed approach significantly enhances the accuracy and efficiency of thermal model,this contributes to the precise thermal control of subsequent infrared optical payloads. 展开更多
关键词 thermal model intelligent correlation method surrogate model infrared optical payload FY-3E
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Evaluation of damage evolution in pure magnesium during surrogate high-energy electron irradiation for Brachytherapy seed application
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作者 Hucheng Yu Sichen Dong +7 位作者 Qi Chen Xiaoou Yi Hui Liu Hao Fang Wentuo Han Pingping Liu Somei Ohnuki Farong Wan 《Journal of Magnesium and Alloys》 2025年第7期3104-3121,共18页
Evaluation of damage evolution effects in biodegradable pure Mg was carried out,using transmission electron microscope as surrogate irradiation for high-energy radionuclide β decay in Brachytherapy.Time-dependent qua... Evaluation of damage evolution effects in biodegradable pure Mg was carried out,using transmission electron microscope as surrogate irradiation for high-energy radionuclide β decay in Brachytherapy.Time-dependent quantitative defect production,evolution dynamics,and evolution statistics were revealed in-situ for two prism foils(z=[1.210],[10.10]),in as-received and heat-treated pure Mg,after 300 keV electron irradiation up to 0.468 dpa at R.T.Preferred nucleation of basal-plane interstitial-type 1/6<20.23>loops was confirmed,in addition to a small portion of prism-plane 1/3<11.20>loops.No cavities were found.A higher yield of point defect concentration and a more evident trend of defect coarsening were identified in[1.210]than in[10.10].Pre-existing dislocations(on the orders of 10^(13)−10^(14) m^(−2))in pure Mg resulted in a delay of the first occurrence of visible defects.Defect migration and elastic interactions governed the microstructural evolution of electron irradiation damage in pure Mg,giving rise to events of loop coalescence,growth,and sometimes rotation of habit plane.The influence of incident electron energy can be correlated to the rates of point defect production,and is quantifiable;however,interfered by defect cluster stability,defect mobility,and defect interactions.This forms an important theoretical basis for the application of Mg subjected to MeV-level β-decay radiation in Brachytherapy.The paper concludes with a brief comparison between Mg and conventional Ti casing,outlines the advantages and challenges,and provides reference points for the validation of Mg/Mg-alloys in Brachytherapy seed application. 展开更多
关键词 Magnesium BRACHYTHERAPY Radionuclideβdecay Surrogate irradiation Prism orientation Damage evolution
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Accelerating multi-objective catalytic material design:A model-based method
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作者 Baolei Li Da Wang +7 位作者 Miao Yu Chaozheng He Xue Li Jing Zhai Mdmahadi Hasan Chenxu Zhao Min Wang Dingcai Shen 《Chinese Chemical Letters》 2025年第12期363-367,共5页
Cobalt phosphide has been successfully used as a catalyst in the production of ammonia from nitric acid.Substituting appropriate atoms is expected to further improve its catalytic performance.Owing to the diversity of... Cobalt phosphide has been successfully used as a catalyst in the production of ammonia from nitric acid.Substituting appropriate atoms is expected to further improve its catalytic performance.Owing to the diversity of substituting elements,substitution sites,adsorption sites,and adsorption configurations,extensive time-consuming simulation calculations are required for the high-throughput screening method.Additionally,multi-objective attributes should be considered simultaneously in catalytic design.To tackle this challenge,this paper suggests a multi-objective cobalt phosphide catalytic material design method based on surrogate models.And the effectiveness of the proposed method was validated through comparative experiments.The proposed method led to the discovery of fifteen promising cobalt phosphide catalyst configurations.This study provides a new avenue for expediting the design of catalyst,with the potential for application in other systems. 展开更多
关键词 Surrogate model MULTI-OBJECTIVE Catalytic design Cobalt phosphide Simulation calculations
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Output power prediction of stratospheric airship solar array based on surrogate model under global wind field
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作者 Kangwen SUN Siyu LIU +3 位作者 Yixiang GAO Huafei DU Dongji CHENG Zhiyao WANG 《Chinese Journal of Aeronautics》 2025年第4期221-232,共12页
Stratospheric airships are lighter-than-air vehicles capable of continuous flying for months.The energy balance of the airship is the key to long-duration flights.The stratospheric airship is entirely powered by the s... Stratospheric airships are lighter-than-air vehicles capable of continuous flying for months.The energy balance of the airship is the key to long-duration flights.The stratospheric airship is entirely powered by the solar array.It is necessary to accurately predict the output power of the array for any flight state.Because of the uneven solar radiation received by the solar array,the traditional model based on components has a slow simulation speed.In this study,a data-driven surrogate modeling approach for prediction the output power of the solar array is proposed.The surrogate model is trained using the samples obtained from the high-accuracy simulation model.By using the input parameter preprocessor,the accuracy of the surrogate model in predicting the output power of the solar array is improved to 98.65%.In addition,the predictive speed of the surrogate model is ten million times faster than the traditional simulation model.Finally,the surrogate model is used to predict the energy balance of stratospheric airships flying throughout the year under actual global wind fields. 展开更多
关键词 Stratospheric airship Solar array Output power Surrogate model Global wind field Energy balance
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Entire aerial-aquatic trajectory modeling and optimization for trans- medium vehicles
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作者 Teng Long Nianhui Ye +2 位作者 Baoshou Zhang Jingliang Sun Renhe Shi 《Defence Technology(防务技术)》 2025年第7期223-241,共19页
Trans-medium flight vehicles can combine high aerial maneuverability and underwater concealment ability,which have attracted much attention recently.As the most crucial procedure,the trajectory design generally determ... Trans-medium flight vehicles can combine high aerial maneuverability and underwater concealment ability,which have attracted much attention recently.As the most crucial procedure,the trajectory design generally determines the trans-medium flight vehicle performance.To quantitatively analyze the flight vehicle performance,an entire aerial-aquatic trajectory model is developed in this paper.Different from modeling a trajectory purely for the water entry process,the constructed entire trajectory model has integrated aerial,water entry,and underwater trajectories together,which can consider the influence of the connected trajectories.As for the aerial and underwater trajectories,explicit dynamic models are established to obtain the trajectory parameters.Due to the complicated fluid force during high-velocity water entry,a computational fluid dynamics model is investigated to analyze this phase.The compu-tational domain size is adaptively refined according to the final aerial trajectory state,where the redundant computational domain is removed.An entire trajectory optimization problem is then formulated to maximize the total flight range via tuning the joint states of different trajectories.Simultaneously,several constraints,i.e.,the max impact load,trajectory height,etc.,are involved in the optimization problem.Rather than directly optimizing by a heuristic algorithm,a multi-surrogate cooperative sampling-based optimization method is proposed to alleviate the computational complexity of the entire trajectory optimization problem.In this method,various surrogates coopera-tively generate infill sample points,thereby preventing the poor approximation.After optimization,the total flight range can be improved by 20%,while all the constraints are satisfied.The result demonstrates the effectiveness and practicability of the developed model and optimization framework. 展开更多
关键词 Water entry Trans-medium vehicle Computational fluid dynamics Trajectory optimization Pseudospectral method Surrogate
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RIME-VMD-BiLSTM:A surrogate model for seismic response prediction of nonlinear vehicle-track-bridge system
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作者 LIU Han-yun WANG Zi-yi +3 位作者 HAN Yan ZHOU Na-ya MAO Jian-feng JIANG Li-zhong 《Journal of Central South University》 2025年第10期4073-4091,共19页
This paper proposed a RIME-VMD-BiLSTM surrogate model to rapidly and precisely predict the seismic response of a nonlinear vehicle-track-bridge(VTB)system.The surrogate model employs the RIME algorithm to optimize the... This paper proposed a RIME-VMD-BiLSTM surrogate model to rapidly and precisely predict the seismic response of a nonlinear vehicle-track-bridge(VTB)system.The surrogate model employs the RIME algorithm to optimize the variational mode decomposition(VMD)parameters(k and α)and the architecture and hyperparameter of the bidirectional long-and short-term memory network(BiLSTM).After comparing different combinations and optimization algorithms,the surrogate model was trained and used to analyze a typical 9-span 32-m high-speed railway simply supported bridge system.A series of numerical examples considering the vehicle speed,bridge damping,seismic intensity,and training strategy on the prediction effect of the surrogate model were conducted on the extended OpenSees platform.The results show that the BiLSTM model performed better than the LSTM model,whereas the prediction effects of the single-LSTM and BiLSTM models were relatively poor.With the introduction of the VMD and RIME optimization techniques,the prediction effect of the proposed RIME-VMD-BiLSTM model was excellent.The abovementioned factors had a significant influence on the seismic response of a VTB system but little impact on the prediction effect of the surrogate model.The proposed surrogate model exhibits notable transferability and robustness for predicting the VTB’s nonlinear seismic response. 展开更多
关键词 seismic response prediction vehicle-track-bridge system surrogate model BiLSTM neural network OpenSees platform
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Integrated optimization of reservoir production and layer configurations using relational and regression machine learning models
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作者 Qin-Yang Dai Li-Ming Zhang +6 位作者 Kai Zhang Hao Hao Guo-Dong Chen Xia Yan Pi-Yang Liu Bao-Bin Zhang Chen-Yang Wang 《Petroleum Science》 2025年第9期3745-3759,共15页
This study introduces a novel approach to addressing the challenges of high-dimensional variables and strong nonlinearity in reservoir production and layer configuration optimization.For the first time,relational mach... This study introduces a novel approach to addressing the challenges of high-dimensional variables and strong nonlinearity in reservoir production and layer configuration optimization.For the first time,relational machine learning models are applied in reservoir development optimization.Traditional regression-based models often struggle in complex scenarios,but the proposed relational and regression-based composite differential evolution(RRCODE)method combines a Gaussian naive Bayes relational model with a radial basis function network regression model.This integration effectively captures complex relationships in the optimization process,improving both accuracy and convergence speed.Experimental tests on a multi-layer multi-channel reservoir model,the Egg reservoir model,and a real-field reservoir model(the S reservoir)demonstrate that RRCODE significantly reduces water injection and production volumes while increasing economic returns and cumulative oil recovery.Moreover,the surrogate models employed in RRCODE exhibit lightweight characteristics with low computational overhead.These results highlight RRCODE's superior performance in the integrated optimization of reservoir production and layer configurations,offering more efficient and economically viable solutions for oilfield development. 展开更多
关键词 Surrogate model Reservoir management Evolutionary algorithm Joint optimization Layer configuration Production optimization Relational learning
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