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Quantifying the solid electrolyte interphase stress induced capacity fading of lithium-ion batteries via a multiscale mechanical-electrochemical coupling model

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science China Technological sciences 2024年第10期67卷 3168-3181页

作者： HE YaoLong XU Peng JIANG DengFeng HU HongJiu LI DaWei SHI SiQi shanghai Institute of Applied Mathematics and Mechanics School of Mechanics and Engineering ScienceShanghai University shanghai Key Laboratory of Mechanics in Energy engineering Shanghai University shanghai Frontier science Center of Mechanoinformatics Shanghai University School of Mechanical engineering University of Shanghai for Science and Technology School of Materials science and engineering Shanghai University Materials Genome Institute Shanghai University

The solid electrolyte interphase（SEI） is widely recognized as a critical factor leading to the capacity fading of lithium-ion batteries（LIBs）. Although SEI stress-related mechanical failure caused by the expansion or contraction of active materials upon cycles is well documented, previously reported SEI components and overpotential varying phenomena due to SEI stress and their effects on the electrochemical performance are poorly understood. Here, we establish a quantitative correlation between capacity fading and the SEI stress by considering its effects on side reactions, especially SEI component evolution, in a multiscale mechanical-electrochemical coupling model. Furthermore, the capacity fading behaviors of two typical cells（Li[NiMnCo]O2as the cathode, and graphite and silicon as the anode, respectively） were adopted as numerical examples to demonstrate its potential utility and applications. Stress within the SEI was indeed found to play a predominant role in the capacity fading of the graphite and silicon anodes, resulting in 27% and 69% of the total capacity loss after 200 and 100 cycles at 1 C, respectively. This study provides valuable mechanical insights into the variations of SEI properties related to the capacity degradation and SEI optimization and design for LIBs.

关键词： solid electrolyte interphase capacity fading multiscale mechanical-electrochemical coupling stress analysis

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Al-doped ZnO/WO_(3) heterostructure films prepared by magnetron sputtering for isopropanol sensors

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Rare Metals 2024年第1期43卷 247-256页

作者： Wei-Xiang Gao Xue-Ting Chang Xiao-Jie Zhu Jun-Feng Li Ying-Chang Jiang Dong-Sheng Wang Chuan-Xiao Yang Shi-Bin Sun College of Logistics engineering Shanghai Maritime UniversityShanghai 201306China College of Ocean science and engineering Shanghai Maritime UniversityShanghai 201306China Institute of Logistics science and engineering Shanghai Maritime UniversityShanghai 201306China

Metal oxide semiconductors(MOSs) are ideal sensing materials for detecting volatile organic compounds due to their low cost, diversity, high stability, and ease of production. However, it remains a grand challenge to develop the MOSs-based gas sensors for sensing isopropanol with desired performance via a simple, effective,and controllable method. Herein, we reported the preparation of the Al-doped Zn O(AZO)/WO_(3) heterostructure films by directly depositing the AZO coating onto the WO_(3) coating using a strategy of magnetron sputtering. The AZO/WO_(3) heterostructure films were constructed by numbers of irregular nanoparticles that were interconnected with each other. The AZO/WO_(3) heterostructure films-based gas sensors exhibited excellent isopropanolsensing performance with high response, promising selectivity, low detection limit, fast response rate, wide detection range, and ideal reproducibility. The promising isopropanol-sensing performance of the AZO/WO_(3) heterostructure films arises mainly from their high uniformity, unique microstructures with high surface roughness,and the construction of the heterostructure between the AZO and WO_(3) coatings. This work provides a versatile approach to prepare the MOSs-based heterostructure films for assembling the gas sensors.

关键词： Metal oxide semiconductors Gas sensors Aldoped ZnO/WO_(3) Heterostructure films Isopropanol Magnetron sputtering

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Effects of cross-Kerr coupling on transmission spectrum of double-cavity optomechanical system

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Chinese Physics B 2024年第6期33卷 390-396页

作者：陈立滕秦立国田立君黄接辉周南润龚尚庆 School of Mathematics Physics and StatisticsShanghai University of Engineering ScienceShanghai 201620China Department of Physics Shanghai UniversityShanghai 200444China School of Electrical engineering Shanghai University of Engineering ScienceShanghai 201620China School of Physics East China University of Science and TechnologyShanghai 200237China

We theoretically study the transmission spectrum of the cavity field in a double-cavity optomechanical system with cross-Kerr(CK) effect. The system consists of two tunneling coupling optomechanical cavities with a mechanical resonator as a coupling interface. By doping CK medium into the mechanical resonator, CK couplings between the cavity fields and the mechanical resonator are introduced. We investigate the effects of CK coupling strength on the transmission spectrum of the cavity field, including the transmission rate, nonreciprocity and four-wave mixing(FWM). We find that the transmission spectrum of the probe field can show two obvious transparent windows, which can be widened by increasing the CK coupling strength. For the transmission between the two cavity fields, the perfect nonreciprocity and reciprocity are present and modulated by CK coupling and phase difference between two effective optomechanical couplings. In addition, the effects of the optomechanical and CK couplings on FWM show that the single peak of FWM is split into three symmetrical peaks due to the introduction of the CK effect.

关键词： cross-Kerr transmission rate nonreciprocity four-wave mixing

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Effect of stress-relief annealing on thermal fatigue cracks for die-casting die steels

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Journal of Iron and Steel Research International 2024年第5期31卷 1164-1176页

作者： Zhi-xiong Bai Xiao-chun Wu School of Materials science and engineering Shanghai UniversityShanghai200444China

The effect of stress-relief annealing at different stages of thermal fatigue tests on crack growth was investigated using a self-built thermal cycle *** results showed that annealing could limit crack expansion *** reduced dislocation density and released the accumulation of residual *** addition,the strain accumulation in carbides was reduced by this *** was also found that double annealing was even more effective at inhibiting crack expansion compared to single stress-relief *** 1000 cycles,the maximum crack length was reduced by 31.1%and 45.2%for the samples after using the optimal single and double annealing processes,*** single stress-relief annealing,earlier annealing provides more benefit in delaying crack ***,effective double stress-relief annealing requires a suitable time interval between the annealing ***,after 800 cycles,surface hardness decreased significantly accompanied by an increase in the size and number of carbides,and cracks expanded predominantly along grain boundaries.

关键词： Thermal fatigue Steel Carbide Stress-relief annealing Dislocation Residual stress

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A vertical track nonlinear energy sink

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Applied Mathematics and Mechanics(English Edition) 2024年第6期45卷 931-946页

作者： Meng LI Hu DING shanghai Key Laboratory of Mechanics in Energy engineering School of Mechanics and Engineering ScienceShanghai Frontier Science Center of MechanoinformaticsShanghai UniversityShanghai 200444China

Eliminating the effects of gravity and designing nonlinear energy sinks(NESs)that suppress vibration in the vertical direction is a challenging task with numerous damping *** this paper,the dynamic design of a vertical track nonlinear energy sink(VTNES)with zero linear stiffness in the vertical direction is proposed and realized for the first *** motion differential equations of the VTNES coupled with a linear oscillator(LO)are *** the strong nonlinearity considered of the VTNES,the steady-state response of the system is analyzed with the harmonic balance method(HBM),and the accuracy of the HBM is verified *** this basis,the VTNES prototype is manufactured,and its nonlinear stiffness is *** damping effect and dynamic characteristics of the VTNES are studied theoretically and *** results show that the VTNES has better damping effects when strong modulation responses(SMRs)***,even for small-amplitude vibration,the VTNES also has a good vibration suppression *** sum up,in order to suppress the vertical vibration,an NES is designed and developed,which can suppress the vertical vibration within certain ranges of the resonance frequency and the vibration intensity.

关键词： track nonlinear energy sink(TNES) vertical direction gravity nonlinear stiffness harmonic balance method(HBM) vibration control

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Theoretical study on the effect of H_(2)O on the formation mechanism of NO_(x) precursors during indole pyrolysis

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Frontiers of Chemical science and engineering 2024年第6期18卷 99-112页

作者： Ziqi Wang Jun Shen Xuesong Liu Sha Wang Shengxiang Deng Hai Zhang Yun Guo School of Mechanical and Automotive engineering Shanghai University of Engineering ScienceShanghai 201620China School of Mechanical engineering Shanghai Jiao Tong UniversityShanghai 200240China

The incineration technology of kitchen waste is one of the effective technologies to achieve the resource utilization of municipal solid *** is an important stage of *** is a rich initial product in the pyrolysis process of kitchen waste,and the presence of H_(2)O has a significant impact on the decomposition of indole to form NO_(x) ***,this study uses density functional theory method to study the effect of H_(2)O on the thermal decomposition of indole to produce NH_(3),HNCO,and *** H_(2)O participates in the reaction,it can provide oxidative groups to generate a new product HNCO,which is different from the previous findings by indole pyrolysis without the presence of H_(2)***,this study theoretically proves that NH_(3) is easier to form than *** is consistent with the phenomenon that NH_(3) release is higher than HCN release in pyrolysis *** addition,compared with the individual pyrolysis of indole,the participation of H_(2)O reduces the energy barriers for the formation of NH_(3) and HCN during indole pyrolysis,thereby promoting the formation of NH_(3) and HCN.

关键词： indole pyrolysis H_(2)O NO_(x)precursors DFT

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Two-dimensional C_(2)N-based single-atom catalyst with complex microenvironment for enhanced electrochemical nitrogen reduction:A descriptor-based design

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Journal of Energy Chemistry 2024年第10期97卷 110-119,I0003页

作者： Enduo Dai Wei An Ruixian Guo Xugen Shi Yunyi Li Yibo Wang Mingming Liu College of Chemistry and Chemical engineering.shanghai university of engineering science Shanghai 201620China

The catalytic descriptor with operational feasibility is highly desired towards rational design of high-performance catalyst especially the electrode/electrolyte solution interface working under mild ***,we demonstrate that the descriptorΩparameterized by readily accessible intrinsic properties of metal center and coordination is highly operational and efficient in rational design of single-atom catalyst(SAC)for driving electrochemical nitrogen reduction(NRR).Using twodimensional metal(M)-B_(x)P_(y)S_(z)N_m@C_(2)N as prototype SAC models,we reveal that^(*)N_(2)+(H~++e~-)→^(*)N_(2)H acts predominantly as the potential-limiting step(PLS)of NRR on M-B_(2)P_(2)S_(2)@C_(2)N and M-B_(1)P_(1)S_(1)N_(3)@C_(2)N regardless of the distinction in coordination *** the 28 screened M active sites,withΩvalues close to the optimal 4,M-B_(2)P_(2)S_(2)@C_(2)N(M=V(Ω=3.53),Mo(Ω=5.12),and W(Ω=3.92))and M-B_(1)P_(1)S_(1)N_(3)@C_(2)N(M=V(Ω=3.00),Mo(Ω=4.34),and W(Ω=3.32))yield the lowered limiting potential(U_(L))as-0.45,-0.54.-0.36,-0.58,-0.25,and-0.24 V,respectively,thus making them the promising NRR *** importantly,these SACs are located around the top of volcano-shape plot of U_(L) versusΩ,re-validatingΩas an effective descriptor for accurately predicting the high-activity NRR SACs even with complex *** study unravels the relationship between active-site structure and NRR performance via the descriptorΩ,which can be applied to other important sustainable electrocatalytic reactions involving activation of small molecules viaσ-donation andπ^(*)-backdonation mechanism.

关键词： Electrocatalysis N_(2) reduction Single-atom catalyst Descriptor DFT

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Novel self-embedding holographic watermarking image encryption protection scheme

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Chinese Physics B 2024年第5期33卷 281-290页

作者：王励年周楠润孙博曹颖鸿牟俊 School of Information science and engineering Dalian Polytechnic UniversityDalian 116034 China School of Electronic and Electrical engineering Shanghai University of Engineering ScienceShanghai 201620China

For digital image transmission security and information copyright,a new holographic image self-embedding watermarking encryption scheme is ***,the plaintext is converted to the RGB three-color channel,the corresponding phase hologram is obtained by holographic technology and the watermark is self-embedded in the frequency ***,by applying the Hilbert transform principle and genetic center law,a complete set of image encryption algorithms is constructed to realize the encryption of image ***,simulation results and security analysis indicate that the scheme can effectively encrypt and decrypt image information and realize the copyright protection of *** introduced scheme can provide some support for relevant theoretical research,and has practical significance.

关键词： color image encryption Hilbert transform self-embedding watermark holographic technology

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Regulating photothermal properties of near-infrared croconaine dyes by supramolecular assembly

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Nano Research 2024年第9期17卷 8560-8570页

作者： Yangge Ren Yue Lu Juanjuan Gao Yi Ding Bo Zhu Xinyu Hou Lin Jia Department of Polymer Materials School of Materials Science and EngineeringShanghai UniversityShanghai 200444China Department of Electronic Information Materials School of Materials Science and EngineeringShanghai UniversityShanghai 200444China

The photochemical and photophysical properties of near-infrared(NIR)dyes are significantly influenced by their aggregation state and mesoscopic ***,beyond chemical synthesis,the regulation mechanisms for the properties of NIR dyes,particularly with respect to photothermal properties of the aggregates,are not yet fully ***,we investigate the photothermal behaviors of croconaine-based(CroA)NIR dyes containing dipeptide or amino acids *** introduction of hydrogen bonding promotesπ-πstacking of croconaine center,which can efficiently regulate aggregation states and assembly structures in *** laser irradiation,CroA aggregates undergo aggregation-dissociation transition,the in-situ monomer generation process regulates two parameters of photothermal performance:heating rates and plateau photothermal *** study reveals the regulation effect of non-covalent bonding interactions on CroA aggregates,highlighting supramolecular assembly strategy not only facilitates to construct of photothermal nanomaterials with well-defined structures,but also provides an alternative and effective method for regulating photothermal performance of NIR dyes.

关键词： croconaine dye hydrogen bonding photothermal performance supramolecular assembly chirality

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A Railway Fastener Inspection Method Based on Abnormal Sample Generation

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Computer Modeling in engineering & sciences 2024年第4期139卷 565-592页

作者： Shubin Zheng Yue Wang Liming Li Xieqi Chen Lele Peng Zhanhao Shang Higher Vocational and Technical College Shanghai University of Engineering ScienceShanghai200437China School of Urban Railway Transportation Shanghai University of Engineering ScienceShanghai201620China shanghai engineering Research Centre of Vibration and Noise Control Technologies for Rail Transit Shanghai University of Engineering ScienceShanghai201620China

Regular fastener detection is necessary to ensure the safety of ***,the number of abnormal fasteners is significantly lower than the number of normal fasteners in real *** supervised inspectionmethods have insufficient detection ability in cases of imbalanced *** solve this problem,we propose an approach based on deep convolutional neural networks(DCNNs),which consists of three stages:fastener localization,abnormal fastener sample generation based on saliency detection,and fastener state ***,a lightweight YOLOv5s is designed to achieve fast and precise localization of fastener ***,the foreground clip region of a fastener image is extracted by the designed fastener saliency detection network(F-SDNet),combined with data augmentation to generate a large number of abnormal fastener samples and balance the number of abnormal and normal ***,a fastener inspection model called Fastener ResNet-8 is constructed by being trained with the augmented fastener *** show the effectiveness of our proposed method in solving the problem of sample imbalance in fastener *** and quantitative comparisons show that the proposed F-SDNet outperforms other state-of-the-art methods in clip region extraction,reaching MAE and max F-measure of 0.0215 and 0.9635,*** addition,the FPS of the fastener state inspection model reached 86.2,and the average accuracy reached 98.7%on 614 augmented fastener test sets and 99.9%on 7505 real fastener datasets.

关键词： Railway fastener sample generation inspection model deep learning

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