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Prediction model for corrosion rate of low-alloy steels under atmospheric conditions using machine learning algorithms 被引量:2
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作者 Jingou Kuang Zhilin Long 《International Journal of Minerals,Metallurgy and Materials》 SCIE EI CAS CSCD 2024年第2期337-350,共14页
This work constructed a machine learning(ML)model to predict the atmospheric corrosion rate of low-alloy steels(LAS).The material properties of LAS,environmental factors,and exposure time were used as the input,while ... This work constructed a machine learning(ML)model to predict the atmospheric corrosion rate of low-alloy steels(LAS).The material properties of LAS,environmental factors,and exposure time were used as the input,while the corrosion rate as the output.6 dif-ferent ML algorithms were used to construct the proposed model.Through optimization and filtering,the eXtreme gradient boosting(XG-Boost)model exhibited good corrosion rate prediction accuracy.The features of material properties were then transformed into atomic and physical features using the proposed property transformation approach,and the dominant descriptors that affected the corrosion rate were filtered using the recursive feature elimination(RFE)as well as XGBoost methods.The established ML models exhibited better predic-tion performance and generalization ability via property transformation descriptors.In addition,the SHapley additive exPlanations(SHAP)method was applied to analyze the relationship between the descriptors and corrosion rate.The results showed that the property transformation model could effectively help with analyzing the corrosion behavior,thereby significantly improving the generalization ability of corrosion rate prediction models. 展开更多
关键词 machine learning low-alloy steel atmospheric corrosion prediction corrosion rate feature fusion
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An MPI parallel DEM-IMB-LBM framework for simulating fluid-solid interaction problems 被引量:2
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作者 Ming Xia Liuhong Deng +3 位作者 Fengqiang Gong Tongming Qu Y.T.Feng Jin Yu 《Journal of Rock Mechanics and Geotechnical Engineering》 SCIE CSCD 2024年第6期2219-2231,共13页
The high-resolution DEM-IMB-LBM model can accurately describe pore-scale fluid-solid interactions,but its potential for use in geotechnical engineering analysis has not been fully unleashed due to its prohibitive comp... The high-resolution DEM-IMB-LBM model can accurately describe pore-scale fluid-solid interactions,but its potential for use in geotechnical engineering analysis has not been fully unleashed due to its prohibitive computational costs.To overcome this limitation,a message passing interface(MPI)parallel DEM-IMB-LBM framework is proposed aimed at enhancing computation efficiency.This framework utilises a static domain decomposition scheme,with the entire computation domain being decomposed into multiple subdomains according to predefined processors.A detailed parallel strategy is employed for both contact detection and hydrodynamic force calculation.In particular,a particle ID re-numbering scheme is proposed to handle particle transitions across sub-domain interfaces.Two benchmarks are conducted to validate the accuracy and overall performance of the proposed framework.Subsequently,the framework is applied to simulate scenarios involving multi-particle sedimentation and submarine landslides.The numerical examples effectively demonstrate the robustness and applicability of the MPI parallel DEM-IMB-LBM framework. 展开更多
关键词 Discrete element method(DEM) Lattice Boltzmann method(LBM) Immersed moving boundary(IMB) Multi-cores parallelization Message passing interface(MPI) CPU Submarine landslides
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A particle-resolved heat-particle-fluid coupling model by DEM-IMB-LBM 被引量:1
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作者 Ming Xia Jinlong Fu +2 位作者 Y.T.Feng Fengqiang Gong Jin Yu 《Journal of Rock Mechanics and Geotechnical Engineering》 SCIE CSCD 2024年第6期2267-2281,共15页
Multifield coupling is frequently encountered and also an active area of research in geotechnical engineering.In this work,a particle-resolved direct numerical simulation(PR-DNS)technique is extended to simulate parti... Multifield coupling is frequently encountered and also an active area of research in geotechnical engineering.In this work,a particle-resolved direct numerical simulation(PR-DNS)technique is extended to simulate particle-fluid interaction problems involving heat transfer at the grain level.In this extended technique,an immersed moving boundary(IMB)scheme is used to couple the discrete element method(DEM)and lattice Boltzmann method(LBM),while a recently proposed Dirichlet-type thermal boundary condition is also adapted to account for heat transfer between fluid phase and solid particles.The resulting DEM-IBM-LBM model is robust to simulate moving curved boundaries with constant temperature in thermal flows.To facilitate the understanding and implementation of this coupled model for non-isothermal problems,a complete list is given for the conversion of relevant physical variables to lattice units.Then,benchmark tests,including a single-particle sedimentation and a two-particle drafting-kissing-tumbling(DKT)simulation with heat transfer,are carried out to validate the accuracy of our coupled technique.To further investigate the role of heat transfer in particle-laden flows,two multiple-particle problems with heat transfer are performed.Numerical examples demonstrate that the proposed coupling model is a promising high-resolution approach for simulating the heat-particle-fluid coupling at the grain level. 展开更多
关键词 Particle-fluid interaction Heat transfer Discrete element method(DEM) Lattice Boltzmann method(LBM) Dirichlet-type thermal boundary Direct numerical simulation
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Deformable Catalytic Material Derived from Mechanical Flexibility for Hydrogen Evolution Reaction 被引量:2
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作者 Fengshun Wang Lingbin Xie +7 位作者 Ning Sun Ting Zhi Mengyang Zhang Yang Liu Zhongzhong Luo Lanhua Yi Qiang Zhao Longlu Wang 《Nano-Micro Letters》 SCIE EI CAS CSCD 2024年第2期287-311,共25页
Deformable catalytic material with excellent flexible structure is a new type of catalyst that has been applied in various chemical reactions,especially electrocatalytic hydrogen evolution reaction(HER).In recent year... Deformable catalytic material with excellent flexible structure is a new type of catalyst that has been applied in various chemical reactions,especially electrocatalytic hydrogen evolution reaction(HER).In recent years,deformable catalysts for HER have made great progress and would become a research hotspot.The catalytic activities of deformable catalysts could be adjustable by the strain engineering and surface reconfiguration.The surface curvature of flexible catalytic materials is closely related to the electrocatalytic HER properties.Here,firstly,we systematically summarized self-adaptive catalytic performance of deformable catalysts and various micro–nanostructures evolution in catalytic HER process.Secondly,a series of strategies to design highly active catalysts based on the mechanical flexibility of lowdimensional nanomaterials were summarized.Last but not least,we presented the challenges and prospects of the study of flexible and deformable micro–nanostructures of electrocatalysts,which would further deepen the understanding of catalytic mechanisms of deformable HER catalyst. 展开更多
关键词 Deformable catalytic material Micro-nanostructures evolution Mechanical flexibility Hydrogen evolution reaction
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Lithium-Ion Charged Polymer Channels Flattening Lithium Metal Anode 被引量:2
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作者 Haofan Duan Yu You +11 位作者 Gang Wang Xiangze Ou Jin Wen Qiao Huang Pengbo Lyu Yaru Liang Qingyu Li Jianyu Huang Yun‑Xiao Wang Hua‑Kun Liu Shi Xue Dou Wei‑Hong Lai 《Nano-Micro Letters》 SCIE EI CAS CSCD 2024年第4期379-393,共15页
The concentration difference in the near-surface region of lithium metal is the main cause of lithium dendrite growth.Resolving this issue will be key to achieving high-performance lithium metal batteries(LMBs).Herein... The concentration difference in the near-surface region of lithium metal is the main cause of lithium dendrite growth.Resolving this issue will be key to achieving high-performance lithium metal batteries(LMBs).Herein,we construct a lithium nitrate(LiNO_(3))-implanted electroactiveβphase polyvinylidene fluoride-co-hexafluoropropylene(PVDF-HFP)crystalline polymorph layer(PHL).The electronegatively charged polymer chains attain lithium ions on the surface to form lithium-ion charged channels.These channels act as reservoirs to sustainably release Li ions to recompense the ionic flux of electrolytes,decreasing the growth of lithium dendrites.The stretched molecular channels can also accelerate the transport of Li ions.The combined effects enable a high Coulombic efficiency of 97.0%for 250 cycles in lithium(Li)||copper(Cu)cell and a stable symmetric plating/stripping behavior over 2000 h at 3 mA cm^(-2)with ultrahigh Li utilization of 50%.Furthermore,the full cell coupled with PHL-Cu@Li anode and Li Fe PO_(4) cathode exhibits long-term cycle stability with high-capacity retention of 95.9%after 900 cycles.Impressively,the full cell paired with LiNi_(0.87)Co_(0.1)Mn_(0.03)O_(2)maintains a discharge capacity of 170.0 mAh g^(-1)with a capacity retention of 84.3%after 100 cycles even under harsh condition of ultralow N/P ratio of 0.83.This facile strategy will widen the potential application of LiNO_(3)in ester-based electrolyte for practical high-voltage LMBs. 展开更多
关键词 Polymer ionic channel Li metal batteries Artificial protective layer Uniform Li deposition Electrochemical performances
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Valorization of Camellia oleifera oil processing byproducts to value-added chemicals and biobased materials: A critical review 被引量:1
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作者 Xudong Liu Yiying Wu +11 位作者 Yang Gao Zhicheng Jiang Zicheng Zhao Wenquan Zeng Mingyu Xie Sisi Liu Rukuan Liu Yan Chao Suli Nie Aihua Zhang Changzhu Li Zhihong Xiao 《Green Energy & Environment》 SCIE EI CAS CSCD 2024年第1期28-53,共26页
The C.oleifera oil processing industry generates large amounts of solid wastes,including C.oleifera shell(COS)and C.oleifera cake(COC).Distinct from generally acknowledged lignocellulosic biomass(corn stover,bamboo,bi... The C.oleifera oil processing industry generates large amounts of solid wastes,including C.oleifera shell(COS)and C.oleifera cake(COC).Distinct from generally acknowledged lignocellulosic biomass(corn stover,bamboo,birch,etc.),Camellia wastes contain diverse bioactive substances in addition to the abundant lignocellulosic components,and thus,the biorefinery utilization of C.oleifera processing byproducts involves complicated processing technologies.This reviewfirst summarizes various technologies for extracting and converting the main components in C.oleifera oil processing byproducts into value-added chemicals and biobased materials,as well as their potential applications.Microwave,ultrasound,and Soxhlet extractions are compared for the extraction of functional bioactive components(tannin,flavonoid,saponin,etc.),while solvothermal conversion and pyrolysis are discussed for the conversion of lignocellulosic components into value-added chemicals.The application areas of these chemicals according to their properties are introduced in detail,including utilizing antioxidant and anti-in-flammatory properties of the bioactive substances for the specific application,as well as drop-in chemicals for the substitution of unrenewable fossil fuel-derived products.In addition to chemical production,biochar fabricated from COS and its applications in thefields of adsorption,supercapacitor,soil remediation and wood composites are comprehensively reviewed and discussed.Finally,based on the compositions and structural characteristics of C.oleifera byproducts,the development of full-component valorization strategies and the expansion of the appli-cationfields are proposed. 展开更多
关键词 Camellia oleifera shell Camellia oleifera cake Value-added chemicals Bioactive components Biobased materials
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Dynamics and synchronization in a memristor-coupled discrete heterogeneous neuron network considering noise
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作者 晏询 李志军 李春来 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第2期537-544,共8页
Research on discrete memristor-based neural networks has received much attention.However,current research mainly focuses on memristor–based discrete homogeneous neuron networks,while memristor-coupled discrete hetero... Research on discrete memristor-based neural networks has received much attention.However,current research mainly focuses on memristor–based discrete homogeneous neuron networks,while memristor-coupled discrete heterogeneous neuron networks are rarely reported.In this study,a new four-stable discrete locally active memristor is proposed and its nonvolatile and locally active properties are verified by its power-off plot and DC V–I diagram.Based on two-dimensional(2D)discrete Izhikevich neuron and 2D discrete Chialvo neuron,a heterogeneous discrete neuron network is constructed by using the proposed discrete memristor as a coupling synapse connecting the two heterogeneous neurons.Considering the coupling strength as the control parameter,chaotic firing,periodic firing,and hyperchaotic firing patterns are revealed.In particular,multiple coexisting firing patterns are observed,which are induced by different initial values of the memristor.Phase synchronization between the two heterogeneous neurons is discussed and it is found that they can achieve perfect synchronous at large coupling strength.Furthermore,the effect of Gaussian white noise on synchronization behaviors is also explored.We demonstrate that the presence of noise not only leads to the transition of firing patterns,but also achieves the phase synchronization between two heterogeneous neurons under low coupling strength. 展开更多
关键词 heterogeneous neuron network discrete memristor coexisting attractors SYNCHRONIZATION noise
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金属螯合蛋白异源表达提高E.coli对镉的生物吸附能力:修复潜力和潜在机制
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作者 武晨 吴玉俊 +1 位作者 易盛炜 李峰 《Journal of Central South University》 SCIE EI CAS CSCD 2024年第4期1265-1275,共11页
镉(Cd)作为一种生物非必需的有毒重金属,通过自然排放或人类活动进入环境,对人类健康构成威胁。在微生物中高效表达金属螯合蛋白(MCP)可以增强生物对Cd的吸附能力。本研究构建了mcp基因编码的MCP的异源表达体系(GEM01),探究了其对Cd的... 镉(Cd)作为一种生物非必需的有毒重金属,通过自然排放或人类活动进入环境,对人类健康构成威胁。在微生物中高效表达金属螯合蛋白(MCP)可以增强生物对Cd的吸附能力。本研究构建了mcp基因编码的MCP的异源表达体系(GEM01),探究了其对Cd的吸附效果和潜在机制。结果表明,Cd^(2+)调控GEM01中mcp基因丰度,mcp基因的表达增加了Cd^(2+)的生物吸附能力(8.09 mg/g,比对照组高2.32倍)。在GEM01自溶过程中Cd^(2+)的保留率为87.87%。荧光光谱和分子动力学模拟表明了Cd^(2+)与MCP之间存在较强的相互作用且Cd^(2+)影响了MCP的二级结构。FT-IR证明了MCP中的官能团(如羧基、甲基和亚甲基)参与了MCP与Cd^(2+)的相互作用。分子对接进一步表明MCP蛋白表面的一些极性和亲水残基(如天冬酰胺、谷氨酰胺、丝氨酸和组氨酸)通过静电引力与Cd^(2+)结合。本研究为MCP介导的Cd^(2+)生物修复提供了新的见解,为微生物修复重金属污染提供了基因资源。 展开更多
关键词 mcp基因 金属螯合蛋白 相互作用 微生物修复
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Dynamical behaviors in discrete memristor-coupled small-world neuronal networks
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作者 鲁婕妤 谢小华 +3 位作者 卢亚平 吴亚联 李春来 马铭磷 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第4期729-734,共6页
The brain is a complex network system in which a large number of neurons are widely connected to each other and transmit signals to each other.The memory characteristic of memristors makes them suitable for simulating... The brain is a complex network system in which a large number of neurons are widely connected to each other and transmit signals to each other.The memory characteristic of memristors makes them suitable for simulating neuronal synapses with plasticity.In this paper,a memristor is used to simulate a synapse,a discrete small-world neuronal network is constructed based on Rulkov neurons and its dynamical behavior is explored.We explore the influence of system parameters on the dynamical behaviors of the discrete small-world network,and the system shows a variety of firing patterns such as spiking firing and triangular burst firing when the neuronal parameterαis changed.The results of a numerical simulation based on Matlab show that the network topology can affect the synchronous firing behavior of the neuronal network,and the higher the reconnection probability and number of the nearest neurons,the more significant the synchronization state of the neurons.In addition,by increasing the coupling strength of memristor synapses,synchronization performance is promoted.The results of this paper can boost research into complex neuronal networks coupled with memristor synapses and further promote the development of neuroscience. 展开更多
关键词 small-world networks Rulkov neurons MEMRISTOR SYNCHRONIZATION
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Dynamical behavior of memristor-coupled heterogeneous discrete neural networks with synaptic crosstalk
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作者 马铭磷 熊康灵 +1 位作者 李志军 贺少波 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第2期545-550,共6页
Synaptic crosstalk is a prevalent phenomenon among neuronal synapses,playing a crucial role in the transmission of neural signals.Therefore,considering synaptic crosstalk behavior and investigating the dynamical behav... Synaptic crosstalk is a prevalent phenomenon among neuronal synapses,playing a crucial role in the transmission of neural signals.Therefore,considering synaptic crosstalk behavior and investigating the dynamical behavior of discrete neural networks are highly necessary.In this paper,we propose a heterogeneous discrete neural network(HDNN)consisting of a three-dimensional KTz discrete neuron and a Chialvo discrete neuron.These two neurons are coupled mutually by two discrete memristors and the synaptic crosstalk is considered.The impact of crosstalk strength on the firing behavior of the HDNN is explored through bifurcation diagrams and Lyapunov exponents.It is observed that the HDNN exhibits different coexisting attractors under varying crosstalk strengths.Furthermore,the influence of different crosstalk strengths on the synchronized firing of the HDNN is investigated,revealing a gradual attainment of phase synchronization between the two discrete neurons as the crosstalk strength decreases. 展开更多
关键词 discrete memristor synaptic crosstalk coexisting attractor phase synchronization
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Multiple mixed state variable incremental integration for reconstructing extreme multistability in a novel memristive hyperchaotic jerk system with multiple cubic nonlinearity
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作者 王梦蛟 辜玲芳 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第2期238-246,共9页
Memristor-based chaotic systems with infinite equilibria are interesting because they generate extreme multistability.Their initial state-dependent dynamics can be explained in a reduced-dimension model by converting ... Memristor-based chaotic systems with infinite equilibria are interesting because they generate extreme multistability.Their initial state-dependent dynamics can be explained in a reduced-dimension model by converting the incremental integration of the state variables into system parameters.However,this approach cannot solve memristive systems in the presence of nonlinear terms other than the memristor term.In addition,the converted state variables may suffer from a degree of divergence.To allow simpler mechanistic analysis and physical implementation of extreme multistability phenomena,this paper uses a multiple mixed state variable incremental integration(MMSVII)method,which successfully reconstructs a four-dimensional hyperchaotic jerk system with multiple cubic nonlinearities except for the memristor term in a three-dimensional model using a clever linear state variable mapping that eliminates the divergence of the state variables.Finally,the simulation circuit of the reduced-dimension system is constructed using Multisim simulation software and the simulation results are consistent with the MATLAB numerical simulation results.The results show that the method of MMSVII proposed in this paper is useful for analyzing extreme multistable systems with multiple higher-order nonlinear terms. 展开更多
关键词 extreme multistability HYPERCHAOTIC jerk system nonlinearity
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磁性石化污泥生物炭对土壤镉污染修复研究
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作者 吴玉俊 刘丽坪 +4 位作者 李峰 唐艺欣 葛飞 田江 张明 《Journal of Central South University》 SCIE EI CAS CSCD 2024年第4期1360-1370,共11页
生物炭普遍被认为是一种很有前途的土壤修复材料,特别是因为它能够通过吸附作用而降低土壤中镉(Cd)的生物有效性。然而,长期修复过程中可能会导致Cd从稳定状态释放出来,这使得生物炭作为Cd吸附剂的回收逐渐得到关注。本研究旨在利用含... 生物炭普遍被认为是一种很有前途的土壤修复材料,特别是因为它能够通过吸附作用而降低土壤中镉(Cd)的生物有效性。然而,长期修复过程中可能会导致Cd从稳定状态释放出来,这使得生物炭作为Cd吸附剂的回收逐渐得到关注。本研究旨在利用含铁石油污泥一步合成磁性生物炭,研究其对Cd的吸附效率、钝化机理及其在土壤中的应用效果。结果表明,通过缺氧热解可直接将石化污泥废弃物资源化成磁性生物炭(PSMBCs),且PSMBCs在水/土壤中具有良好的回收性能。具体来说,由于其具有表面矿化和阳离子-π配位作用,本研究制备的PSMBCs对Cd的吸附能力为18.4~29.8 mg/g。在水稻泥土中施用1.5%PSMBCs 30 d后,生物有效态Cd含量降低85%,且伴随着土壤pH值和溶解有机质的增加。此外,生物炭浸出液对小麦根系伸长无毒性影响。因此,本研究为石化污泥的资源化处理及其对Cd污染土壤的修复提供了技术参考。 展开更多
关键词 石化污泥 缺氧热解 磁性生物炭 土壤修复
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Optical spectrum of ferrovalley materials:A case study of Janus H-VSSe
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作者 罗朝波 刘文超 彭向阳 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第1期54-59,共6页
As opposed to the prototypical MoS2 with centroasymmetry,Janus ferrovalley materials such as H-VSSe are less symmetric with the mirror symmetry and time reversal symmetry broken,and hence possess spontaneous valley po... As opposed to the prototypical MoS2 with centroasymmetry,Janus ferrovalley materials such as H-VSSe are less symmetric with the mirror symmetry and time reversal symmetry broken,and hence possess spontaneous valley polarization and strong ferroelasticity.The optical transition is an important means to excite the valley carriers.We investigate the optical spectrum of H-VSSe by using the many-body perturbation-based GW approach and solving the Bethe–Salpeter equation(BSE)to include the electron–hole interactions.It is found that after the GW correction,the band gaps of the quasiparticle bands are much larger than those obtained by the normal density functional theory.The system is ferromagnetic and the valley gaps become non-degenerate due to spin–orbit coupling(SOC).The position of the lowest BSE peak is much lower than the quasiparticle band gap,indicating that the excitonic effect is large.The peak is split into two peaks by the SOC.The binding energy difference between these two BSE peaks is about the same as the difference between the inequivalent valley gaps.Our results show that in Janus H-VSSe the two lowest exciton peaks are from the two inequivalent valleys with different gaps,in contrast to the A and B exciton peaks of MoS2 which are from the same valley. 展开更多
关键词 infrared spectroscopy magnetic topological insulator Drude model band reconstruction
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Quick Weighing of Passing Vehicles Using the Transfer-Learning-Enhanced Convolutional Neural Network
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作者 Wangchen Yan Jinbao Yang Xin Luo 《Computer Modeling in Engineering & Sciences》 SCIE EI 2024年第6期2507-2524,共18页
Transfer learning could reduce the time and resources required by the training of new models and be therefore important for generalized applications of the trainedmachine learning algorithms.In this study,a transfer l... Transfer learning could reduce the time and resources required by the training of new models and be therefore important for generalized applications of the trainedmachine learning algorithms.In this study,a transfer learningenhanced convolutional neural network(CNN)was proposed to identify the gross weight and the axle weight of moving vehicles on the bridge.The proposed transfer learning-enhanced CNN model was expected to weigh different bridges based on a small amount of training datasets and provide high identification accuracy.First of all,a CNN algorithm for bridge weigh-in-motion(B-WIM)technology was proposed to identify the axle weight and the gross weight of the typical two-axle,three-axle,and five-axle vehicles as they crossed the bridge with different loading routes and speeds.Then,the pre-trained CNN model was transferred by fine-tuning to weigh themoving vehicle on another bridge.Finally,the identification accuracy and the amount of training data required were compared between the two CNN models.Results showed that the pre-trained CNN model using transfer learning for B-WIM technology could be successfully used for the identification of the axle weight and the gross weight for moving vehicles on another bridge while reducing the training data by 63%.Moreover,the recognition accuracy of the pre-trained CNN model using transfer learning was comparable to that of the original model,showing its promising potentials in the actual applications. 展开更多
关键词 Bridge weigh-in-motion transfer learning convolutional neural network
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用于钎焊C/C复合材料的稀土改性还原氧化石墨烯增强AgCuTi复合钎料
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作者 吴靓 李月 +3 位作者 陈锦微 张汭 张乾坤 肖逸锋 《Journal of Central South University》 SCIE EI CAS CSCD 2024年第5期1398-1411,共14页
为了解决钎焊接头中脆性化合物的形成问题,我们设计了一种创新性的稀土改性还原氧化石墨烯增强AgCuTi复合钎料,进而获得了以Ag-Cu共晶为主要组织且脆性化合物生成量合适的钎焊接头。对比分析了有无稀土Ce改性的复合钎料的成分和显微组织... 为了解决钎焊接头中脆性化合物的形成问题,我们设计了一种创新性的稀土改性还原氧化石墨烯增强AgCuTi复合钎料,进而获得了以Ag-Cu共晶为主要组织且脆性化合物生成量合适的钎焊接头。对比分析了有无稀土Ce改性的复合钎料的成分和显微组织,结果表明,经Ce改性后的还原氧化石墨烯在钎料中更加均匀分散。比较了分别采用有无Ce改性的钎料钎焊C/C复合材料-C/C复合材料接头的界面微观结构,并研究了石墨烯含量对接头组织和性能的影响。结果表明,由于经Ce改性的钎料中的还原氧化石墨烯分散性更好,从而细化了焊缝组织,且物相分布更均匀,使得接头的剪切强度明显提高。当石墨烯含量为0.5 wt.%时,使用Ce改性的钎料所得钎焊接头的平均剪切强度最高,为31.82 MPa,提高了50%。 展开更多
关键词 稀土改性 还原氧化石墨烯 复合钎料 C/C复合材料 钎焊
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CFD-PBM coupled modeling of the liquid-liquid dispersion characteristics and structure optimization for Kenics static mixer
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作者 Junhai Deng Shilin Lan +4 位作者 Juchang Wu Shenghua Du Weidong Liu Luchang Han Yefeng Zhou 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2024年第6期173-188,共16页
Kenics static mixers(KSM)are extensively used in industrial mixing-reaction processes by virtue of high mixing efficiency,low power homogenization and easy continuous production.Resolving liquid droplet size and its d... Kenics static mixers(KSM)are extensively used in industrial mixing-reaction processes by virtue of high mixing efficiency,low power homogenization and easy continuous production.Resolving liquid droplet size and its distribution and thus revealing the dispersion characteristics are of great significance for structural optimization and process intensification in the KSM.In this work,a computational fluid dynamics-population balance model(CFD-PBM)coupled method is employed to systematically investigate the effects of operating conditions and structural parameters of KSM on droplet size and its distribution,to further reveal the liquid-liquid dispersion characteristics.Results indicate that higher Reynolds numbers or higher dispersed phase volume fractions increase energy dissipation,reducing Sauter mean diameter(SMD)of dispersed phase droplets and with a shift in droplet size distribution(DSD)towards smaller size.Smaller aspect ratios,greater blade twist and assembly angles amplify shear rate,leading to smaller droplet size and a narrower DSD in the smaller range.The degree of impact exerted by the aspect ratio is notably greater.Notably,mixing elements with different spin enhance shear and stretching efficiency.Compared to the same spin,SMD becomes 3.7-5.8 times smaller in the smaller size range with a significantly narrower distribution.Taking into account the pressure drop and efficiency in a comprehensive manner,optimized structural parameters for the mixing element encompass an aspect ratio of 1-1.5,a blade twist angle of 180°,an assembly angle of 90°,and interlaced assembly of adjacent elements with different spin.This work provides vital theoretical underpinning and future reference for enhancing KSM performance. 展开更多
关键词 CFD Population balance Liquid-liquid dispersion Kenics static mixer
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镍/钼复合中间层钎焊连接C/C复合材料和304不锈钢
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作者 肖逸锋 张汭 +5 位作者 胡忠淇 吴靓 张乾坤 孙妍 李淳 许志鑫 《Journal of Central South University》 SCIE EI CAS CSCD 2024年第3期709-722,共14页
本文使用在BNi-2或AgCuTi箔片钎料中添加金属中间层(Ni、Mo或Ni/Mo)的方法有效提高了C/C复合材料和304不锈钢真空钎焊接头的强度,并先后对接头的微观结构、连接机理和力学性能进行分析。分析表明,BNi-2+Ni/Mo接头的微观结构包括Cr_(3)C_... 本文使用在BNi-2或AgCuTi箔片钎料中添加金属中间层(Ni、Mo或Ni/Mo)的方法有效提高了C/C复合材料和304不锈钢真空钎焊接头的强度,并先后对接头的微观结构、连接机理和力学性能进行分析。分析表明,BNi-2+Ni/Mo接头的微观结构包括Cr_(3)C_(2)、Ni(s,s)、Cr_xNi_(y)+MoNi_(4)、MoNi_(4)+Cr_(x)M_(y)和Ni(s,s)+Cr-Fe;AgCuTi+Ni/Mo接头的界面则由TiC、Ag(s,s)+Cu(s,s)、Ni、Ag(s,s)+Cu(s,s)+MoTi、Mo和MoTi+Cu(s,s)+Ag(s,s)构成。有限元模拟结果表明,AgCuTi钎料加持下的镍/钼复合中间层能够有效缓解C/C母材与焊缝界面间的残余应力。室温下BNi-2+Ni/Mo、AgCuTi+Ni、AgCuTi+Mo和AgCuTi+Ni/Mo钎焊接头的平均剪切强度分别为2.57 MPa、10.91 MPa、23.81 MPa和26.77 MPa,有效验证了有限元结果的可靠性。 展开更多
关键词 C/C复合材料 304不锈钢 真空钎焊 复合中间层 有限元分析
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Phonon transport properties of Janus Pb_(2)XAs(X=P,Sb,and Bi)monolayers:A DFT study
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作者 耿嘉鑫 张培 +1 位作者 汤准韵 欧阳滔 《Chinese Physics B》 SCIE EI CAS CSCD 2024年第4期71-76,共6页
Grasping the underlying mechanisms behind the low lattice thermal conductivity of materials is essential for the efficient design and development of high-performance thermoelectric materials and thermal barrier coatin... Grasping the underlying mechanisms behind the low lattice thermal conductivity of materials is essential for the efficient design and development of high-performance thermoelectric materials and thermal barrier coating materials.In this paper,we present a first-principles calculations of the phonon transport properties of Janus Pb_(2)PAs and Pb_(2)SbAs monolayers.Both materials possess low lattice thermal conductivity,at least two orders of magnitude lower than graphene and h-BN.The room temperature thermal conductivity of Pb_(2)SbAs(0.91 W/m K)is only a quarter of that of Pb_(2)PAs(3.88 W/m K).We analyze in depth the bonding,lattice dynamics,and phonon mode level information of these materials.Ultimately,it is determined that the synergistic effect of low group velocity due to weak bonding and strong phonon anharmonicity is the fundamental cause of the intrinsic low thermal conductivity in these Janus structures.Relative regular residual analysis further indicates that the four-phonon processes are limited in Pb_(2)PAs and Pb_(2)SbAs,and the three-phonon scattering is sufficient to describe their anharmonicity.In this study,the thermal transport properties of Janus Pb_(2)PAs and Pb_(2)SbAs monolayers are illuminated based on fundamental physical mechanisms,and the low lattice thermal conductivity endows them with the potential applications in the field of thermal barriers and thermoelectrics. 展开更多
关键词 lattice thermal conductivity weak bonding phonon anharmonicity first principles calculations
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Solid-state synthesis and ion transport characteristics of the β-KSbF_(4) for all-solid-state fluoride-ion batteries
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作者 Jiali Liu Huahui Zhao +8 位作者 Jingcheng Xia Lingguang Yi Xiaoyi Chen Dongdu Li Shuhan Ni Xinyi Su Yixuan Chen Min Liu Xianyou Wang 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第7期758-767,共10页
All-solid-state fluoride ion batteries(FIBs)have been recently considered as a post-lithium-ion battery system due to their high safety and high energy density.Just like all solid-state lithium batteries,the key to th... All-solid-state fluoride ion batteries(FIBs)have been recently considered as a post-lithium-ion battery system due to their high safety and high energy density.Just like all solid-state lithium batteries,the key to the development of FIBs lies in room-temperature electrolytes with high ionic conductivity.β-KSbF_(4) is a kind of promising solid-state electrolyte for FIBs owing to its rational ionic conductivity and relatively wide electrochemical stability window at room temperature.However,the previous synthesis routes ofβ-KSbF_(4) required the use of highly toxic hydrofluoric acid and the ionic conductivity of as-prepared product needs to be further improved.Herein,the β-KSbF_(4) sample with an ionic conductivity of 1.04×10^(-4)s cm^(-1)(30°C)is synthesized through the simple solid-state route.In order to account for the high ionic conductivity of the as-synthesizedβ-KSbF_(4),X-ray diffraction(XRD),scanning electron microscopy(SEM),and energy dispersive X-ray spectroscopy(EDS)are used to characterize the physic-ochemical properties.The results show that the as-synthesizedβ-KSbF_(4) exhibits higher carrier concentra-tion of 1.0×10^(-6)S cm-Hz^(-1)K and hopping frequency of 1.31×10^(6)Hz at 30°C due to the formation of the fluorine vacancies.Meanwhile,the hopping frequency shows the same trend as the changes of ionic conductivity with the changes of temperature,while the carrier concentration is found to be almost con-stant.The two different trends indicate the hopping frequency is mainly responsible for the ionic conduc-tion behavior withinβ-KSbF_(4).Furthermore,the all-solid-state FIBs,in which Ag and Pb+PbF_(2) are adopted as cathode and anode,andβ-KSbF_(4) as fluoride ion conductor,are capable of reversible charge and discharge.The assembled FIBs show a discharge capacity of 108.4 mA h g^(-1) at 1st cycle and 74.2 mA h g^(-1) at 50th cycle.Based on an examination of the capacity decay mechanism,it has been found that deterioration of the electrolyte/electrode interface is an important reason for hindering the commer-cial application of FIBs.Hence,the in-depth comprehension of the ion transport characteristics inβ-KSbF_(4) and the interpretation of the capacity fading mechanism will be conducive to promoting development of high-performanceFIBs. 展开更多
关键词 Solid-state electrolyte Carrier concentration Hopping frequency β-KSbF_(4) All-solid-state fluoride ion batteries
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Achieving Synergistic Improvement in Dielectric and Energy Storage Properties of All-Organic Poly(Methyl Methacrylate)-Based Copolymers Via Establishing Charge Traps
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作者 Guanghu He Huang Luo +5 位作者 Chuanfang Yan Yuting Wan Dang Wu Hang Luo Yuan Liu Sheng Chen 《Energy & Environmental Materials》 SCIE EI CAS CSCD 2024年第2期308-319,共12页
How to achieve synergistic improvement of permittivity(ε_(r))and breakdown strength(E_(b))is a huge challenge for polymer dielectrics.Here,for the first time,theπ-conjugated comonomer(MHT)can simultaneously promote ... How to achieve synergistic improvement of permittivity(ε_(r))and breakdown strength(E_(b))is a huge challenge for polymer dielectrics.Here,for the first time,theπ-conjugated comonomer(MHT)can simultaneously promote theε_(r)and E_(b)of linear poly(methyl methacrylate)(PMMA)copolymers.The PMMA-based random copolymer films(P(MMA-co-MHT)),block copolymer films(PMMA-b-PMHT),and PMMA-based blend films were prepared to investigate the effects of sequential structure,phase separation structure,and modification method on dielectric and energy storage properties of PMMA-based dielectric films.As a result,the random copolymer P(MMA-coMHT)can achieve a maximumε_(r)of 5.8 at 1 kHz owing to the enhanced orientation polarization and electron polarization.Because electron injection and charge transfer are limited by the strong electrostatic attraction ofπ-conjugated benzophenanthrene group analyzed by the density functional theory(DFT),the discharge energy density value of P(MMA-co-PMHT)containing 1 mol%MHT units with the efficiency of 80%reaches15.00 J cm^(-3)at 872 MV m^(-1),which is 165%higher than that of pure PMMA.This study provides a simple and effective way to fabricate the high performance of polymer dielectrics via copolymerization with the monomer of P-type semi-conductive polymer. 展开更多
关键词 dielectric capacitor electrical properties energy density polymer dielectric semiconductor polymer
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