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SSRN 2024年

作者： Li, Yang Bai, Minli Zhou, Zhifu Wu, Wei-Tao Wei, Lei Hu, Chengzhi Liu, Xinyu Gao, Shuai Li, Yubai Song, Yongchen Key Laboratory of Ocean Energy Utilization and Energy Conservation of Ministry of Education Dalian University of Technology Dalian116023 China State Key Laboratory of Multiphase Flow in Power Engineering Xi'an Jiaotong University Xi'An710049 China School of Mechanical Engineering Nanjing University of Science and Technology Nanjing210094 China Department of Mechanical and Energy Engineering Southern University of Science and Technology Shenzhen518055 China

In this study, a novel FS49-based battery thermal management system (BTMS) was proposed and tested for cooling the prismatic lithium-ion battery (LIB) module. The boiling of dielectric refrigerant occurred at the battery surface, which provided strong and uniform cooling for each battery cell. The results show that the peak temperature difference of liquid immersion cooling (LIC) module during 1C rate discharging and charging was reduced by 91.3% and 94.44%, respectively, compared to the natural convection (NC) module. The reduction of temperature nonuniformity greatly reduced the state of charge (SOC) inhomogeneity of different cells within the module. Moreover, the energy density of LIC module can be optimized by reducing the cell spacing and liquid filling ratio. Comparing with 100% filling rate, the module maximum temperature corresponding to 25% filling rate (with wick) during 2C rate discharging is only increased by 1.6°C, however, the module peak temperature difference is reduced by 53.3%, and the energy density is increased by 13.14%. In addition, Equivalent circuit model (ECM) and volume of fluid (VOF) model were used to simulate the LIC module, and the numerical results are in good agreement with the experimental data. This study provides a systematic design plan and numerical method for the engineering application of LIC in the field of BTMS. © 2024, The Authors. All rights reserved.

关键词： Lithium-ion batteries

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Numerical simulation on forced convection heat transfer in porous media using Gibson‐Ashby constitutive model

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AIP Conference Proceedings 2010年第1期1207卷

作者： J. X. Wang P. Y. Jia Y. S. Wang L. Jiang State Key Laboratory of Multiphase Flow in Power Engineering Xi’an Jiaotong University China

In this article, using Gibson‐Ashby constitutive model, we suggest a new method for numerical investigation of forced convection heat transfer in porous foam metal, and try to consolidate the study for mechanical property and that for thermal characteristic. By available experimental data, we simulated to two cases, namely as the transfer in porous media for diameter is 0.6 mm and porosity is 0.402, and for diameter is 1.6 mm and porosity is 0.462. The result, from our constitutive model for single forced convection heat transfer, corresponds well with the experimental data. As for pressure drop prediction in porous is in good agreement with experiment, and the error is only 5% to 10%, but for transfer is less accurate, the error is about 20%, which is acceptable in practice. So it is done that constitutive model is used to simulate the transfer property.

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Unveiling the Unexpected C-C Dissociation Capacity and Intrinsic Mechanism of Undercoordinated Pd Cluster/Ceo2 for the Efficient and Stable Catalytic Mineralization of Propane

SSRN

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SSRN 2022年

作者： Xia, Lianghui Jian, Yanfei Wang, Jingjing Wang, Yao Chai, Shouning Liu, Yujie Li, Lu Yu, Yanke Albilali, Reem He, Chi State Key Laboratory of Multiphase Flow in Power Engineering School of Energy and Power Engineering Xi'an Jiaotong University Shaanxi Xi’an710049 China Department of Chemistry College of Science Imam Abdulrahman Bin Faisal University P.O. Box 1982 Dammam31441 Saudi Arabia National Engineering Laboratory for VOCs Pollution Control Material & Technology University of Chinese Academy of Sciences Beijing101408 China

Light alkanes extensively presented in industrial exhausts have led tremendous harm to the atmospheric environment and human health. However, their stable molecule structure and inferior adsorption and activation efficiency make them as one category of the most intractable pollutants to be efficient controlled. Herein, we developed a Pd single cluster/CeO2 catalyst (Pd/CeO2-SCC-R) by a scalable deposition precipitation strategy, which demonstrates unexpected activity (propane total destructed below 300 oC) and thermal stability (even dramatically treated at 800 oC for multiple cycles) attributed to the strong metal-support interaction (SMSI) and unsaturated Pd metal sites caused by the shorter Pd-O distance. Mechanism studies determine that the Pd/CeO2-SCC-R possesses highly-efficient C-C cleavage ability owing to the persistent formation of large amounts of oxygen vacancies and low-coordinated Pd species, and the addition of H2O intrinsically accelerates propane activation and intermediate mineralization attributed to suppression of by-products by OH species. In comparison, the Pd single atom/CeO2 catalyst is preferentially for C-H bonds cleavage and inactive for C-C bonds cracking due to the saturated Pd sites anchored to the oxygen of supports directly, which generates more non-oxidation by-products as propyne and propylene, inhibiting the continuous decomposition of propane due to the retardatory oxidation of pyruvate species. The present work sheds critical insight to the production of fulfilling products through the directional cleavage of C-C/C-H bonds in the activation of light alkane molecules. © 2022, The Authors. All rights reserved.

关键词： Oxygen vacancies

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Thermal Simulation for a Mechanical Spindle With External Cooler Across Grease Coated Interface

Research Square

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Research Square 2021年

作者： Zhao, Liang Lei, Mohan Ren, Hongdi Wang, Jinshi Wang, Shuai Li, Ben Q. Yang, Jun Mei, Xuesong Xi'an Jiaotong University China State Key Laboratory for Manufacturing Systems Engineering Xi'an Jiaotong University Xi'An710049 China Shaanxi Key Laboratory of Intelligent Robots Xi'an Jiaotong University Xi'An710049 China School of Mechanical and Precision Instrument Engineering Xi'an University of Technology 710048 China State Key Laboratory of Multiphase Flow in Power Engineering Xi’an Jiaotong University Xi’an710049 China Department of Mechanical Engineering College of Engineering and Computer Science University of Michigan MI48128 United States

Spindles in precision boring machine often work in low speed and heavy load without internal cooling, and the thermal error is nonnegligible. So an external cooling system was designed, and the effectiveness of the designed scheme needs to be preliminarily verified by simulation before building the cooling system. Thermal simulations of the spindle with an external cooler require calculating the thermal resistance of the thermal grease-coated interface between the cooler and spindle. Models describing the contact thermal resistance and total thermal resistance for metal contact filled with silicone grease based on solid-liquid interface force equivalence were described in this paper, and experiments were also conducted to verify the accuracy of these models. The contact thermal resistances between the cast iron/copper and silicone grease on flat or arc surfaces were calculated, and the bulk thermal resistance of the silicone grease layer was calculated. The total heat transferred between the cooler and the silicone grease-coated interface of the spindle were calculated. Heat transfer and heat generation in the spindle were calculated, and a finite element model was established to verify the effectiveness of the designed external cooling scheme. Finally, results from experiments for the spindle in different conditions show that the external cooling system decreases the time to reach thermal equilibrium by more than 60%. The RMSE of the simulated thermal elongation is less than 5.7044 μm when the rotating speed of 3000 rpm, and is less than 3.9714 μm when the rotating speed is 1500 rpm. © 2021, CC BY.

关键词： Cooling

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Curvature Adaptive Voxel-Based Monte Carlo Method with Application for Customized Retinal Laser Surgery

SSRN

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SSRN 2024年

作者： Zhang, Hao Li, Dong Chen, Bin Zhang, Hanfeng Liang, Yao Zheng, Yuping Wang, Guoxiang State Key Laboratory of Multiphase Flow in Power Engineering Xi’an Jiaotong University Xi’an710049 China Department of Ophthalmology 2nd affiliated hospital Medical School Xi’an Jiaotong University Xi’an710049 China Department of Mechanical Engineering The University of Akron AkronOH44325 United States

Accurate prediction of light propagation and energy deposition in biological tissues is crucial for the success of laser-based medical treatments. We propose a novel Curvature Adaptive Voxel-based Monte Carlo method (CAVMC) to correct for light reflection and refraction at curved interfaces by introducing coordinate transformation with an artificial surface parallel to the curved interface. This approach achieves an optimal balance between simulation accuracy and efficiency. Our study demonstrates that for small optical mismatches, the relative error can be reduced significantly, with the energy deposition error dropping from 34.7% to 6.6%. For large optical mismatches, CAVMC substantially improves accuracy, reducing computational errors by more than 50%. We validated CAVMC in a customized retinal laser therapy scenario for diabetic retinopathy, demonstrating its ability to accurately predict laser energy deposition and thermal effects, which is crucial for avoiding tissue damage during treatments. The efficiency and accuracy of the CAVMC method make it valuable for personalized retinal laser surgery and potentially other medical applications. Overall, CAVMC offers a robust tool for simulating light propagation in heterogeneous biological tissues, enhancing the precision and safety of medical treatments. © 2024, The Authors. All rights reserved.

关键词： Laser surgery

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Numerical Simulation of Acoustic Propagation in Gas Ultrasonic flowmeter

SSRN

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SSRN 2022年

作者： Xiao, Yongqing Zhang, Meng Li, Dong Yang, Yueming Ma, Bingkun Qi, Jianhui School of Energy and Power Engineering Shandong University Jinan250061 China Beijing Key Laboratory of Multiphase Flow and Heat Transfer for Low Grade Energy Utilization North China Electric Power University Beijing102206 China Suzhou Research Institute Shandong University Suzhou215123 China Shandon Academy of Sciences China

Ultrasonic flowmeter has been widely used in chemical smelting, industrial production and other fields. Through the COMSOL Multiphysics software, the non-linear trajectory of the rays in the non-invasive and intrusive UFW is first simulated by the ray tracing method. Then, the transient ultrasonic propagation process is simulated to analyze the reasons for the error of ultrasonic propagation. Finally, the cause of the error of the transducer is analyzed by the sound pressure signal at the receiving end. It was found that it is precisely because of the high-speed flow that the ultrasonic propagation is distorted, which is manifested as the non-linear trajectory and downstream drift of the sound beam. The signal at the receiving end also fails to hit the correct position due to beam drift, resulting in sound pressure falling below the detected value. © 2022, The Authors. All rights reserved.

关键词： flow measurement

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Hydrothermal Hydrolysis Modeling of Lignocellulosic Biomass Using Subcritical Water for Test Packed Bed Reactor

SSRN

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SSRN 2023年

作者： Wu, Zhonggang Wang, Jiawei Du, Xiaocheng Su, Hanguang China Nuclear Power Operations Co. Ltd. Shenzhen518116 China Department of Mathematics Physics and Electrical Engineering Northumbria University NewcastleNE1 8ST United Kingdom State Key Laboratory of Multiphase Flow in Power Engineering Xian Jiaotong University Xi'An China School of Information Science and Engineering Northeastern University Shenyang China

In this paper, the subcritical water hydrothermal conversion process of lignocellulosic biomass as porous media in packed bed reactor was investigated by numerical simulation. The computational fluid dynamics mathematical modeling was used to describe the transient multi-physical fields formed during the instantaneous formation process of organic functional groups on the bases of experiment. The effect of inlet hydrothermal fluid velocity and temperature on the transient seepage flow, heat and transfer, and organic conversion reaction were investigated by ANSYS FLUENT® software. The results of the simulation indicate that the osmotic pressure and velocity increase with the hydrothermal fluid velocity and temperature. The surface heat transfer coefficient increases with the hydrothermal fluid velocity and temperature, and may reach the maximum within the scope of this paper. Both experimental and numerical simulation results consistently show that within the first 60 minutes of the hydrothermal reaction, the organic reaction rate is mainly determined by the combined model of turbulent-hydrothermal reaction. For a later time period after 60 minutes, the organic reaction rate mainly depends on the single model of hydrothermal reaction. Comparing the same experimental conditions and their real-time measurements, the numerical results in this paper accord with them. © 2023, The Authors. All rights reserved.

关键词： Porous materials

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Ab initio investigation of defect formation at ZrO2-CeO2 interfaces

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Physical Review B 2012年第8期86卷 085407-085407页

作者： Marco Fronzi Silvia Cereda Yoshitaka Tateyama Alessandro De Vita Enrico Traversa International Center for Materials Nanoarchitectonics (MANA) National Institute for Materials Science (NIMS) Tsukuba Japan Physics Department King's College London Strand London United Kingdom International Research Center for Renewable Energy State Key Laboratory of Multiphase Flow in Power Engineering Xian Jiaotong University Xian Shaanxi China

The structural and electronic properties of low index (100) and (111) ZrO2-CeO2 interfaces are analyzed on the basis of density functional theory calculations. The formation energy and relative stability of substitutional defects, oxygen vacancies, and vacancy-dopant complexes are investigated for the (100) orientation. By comparing these results with the ones obtained in bulk structures, we provide a possible explanation for the higher experimental ionic conductivity measured at the interface.

关键词： ZIRCONIUM oxide CERIUM oxides INTERFACES (Physical sciences) CRYSTAL defects ELECTRONIC structure

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Insight into the key Role of Imine Groups in Polyaniline for Adsorbing Heavy Metal Ions: Experimental and Density Functional Theory Study

SSRN

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SSRN 2023年

作者： Shi, Bofang Li, Hang Fu, Xiaojie Zhao, Chengcheng Rao, Yongfang Li, Mingtao Komarneni, Sridhar Yang, Honghui Xi’an Key Laboratory of Sustainable Energy Materials Chemistry Department of Applied Chemistry School of Chemistry Xi’an Jiaotong University Xi’an710049 China State Key Laboratory of Multiphase Flow in Power Engineering Department of Environmental Science and Engineering School of Energy and Power Engineering Xi’an Jiaotong University Xi’an710049 China Department of Ecosystem Science and Management Materials Research Institute 204EEL The Pennsylvania State University University ParkPA16802 United States

In polyaniline (PANI) or polyaniline-based adsorbents, the views on nitrogen group that has the highest chemical affinity to heavy metal ions and dominates the adsorption process remain in debate. Herein, we focus on deciphering the main adsorption sites and adsorption mechanism of PANI using both experiments and density functional theory (DFT) calculations. The characterization results of adsorption product demonstrate that the metal ions were adsorbed via coordination bond between nitrogen atom and metal ion. The theoretical calculations by DFT reveal that −N= group is the key adsorption site rather than other groups in PANI, and the key step of PANI adsorption process is a ligand exchange reaction. The H+ ions with a higher affinity to −N= group can inhibit the adsorption of metal ions due to the consumption of adsorption sites and ion exchange reaction. This work provides a molecular-level understanding of adsorption sites, adsorption mechanism, and H+ competition for metal ion adsorption by PANI, which is beneficial for the development of PANI-based adsorbents. © 2023, The Authors. All rights reserved.

关键词： Density functional theory

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Waste Tire-Derived Graphene Modified Carbon as Anodes for Sodium-Ion Batteries

SSRN

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SSRN 2024年

作者： Zhou, Ziyi Wang, Silang Wen, Bo Xiao, Jiyuan Yang, Guorui Ding, Shujiang School of Chemistry Engineering Research Center of Energy Storage Materials and Devices Ministry of Education "Four Joint Subjects One Union" School Enterprise Joint Research Center for Power Battery Recycling & Circulation Utilization Technology Xi’an Jiaotong University Xi’an710049 China Xi’an Key Laboratory of Solid Waste Recycling and Resource Recovery State Key Laboratory of Multiphase Flow in Power Engineering Department of Environmental Science and Engineering Xi’an Jiaotong University Xi’an710049 China

The rational disposal of waste tires poses a ubiquitous challenge globally. Pyrolytic carbon black, a solid by-product produced through pyrolysis, has great application prospects. Carbon-based materials are regard as the most potential commercial anode materials for sodium-ion batteries (SIBs) ， which features cheap, environmentally friendly, and low reaction potential. In this study, three-dimensional vertical graphene composite (TCBp@VGSs) was synthesized from waste tires. The graphene with higher defectiveness offers an increased number of active sites for Na+, while the vertically aligned graphene facilitates rapid electron transfer. As a result, the TCBp@VGSs electrode demonstrates the ability to maintain a reversible capacity of 252.7 mA h g-1 after 100 cycles at a current density of 0.2 A g-1. Furthermore, it exhibits a sustained rate performance of 105.4 mA h g-1 at a current density of 5 A g-1. Moreover, even after 1900 cycles at a current density of 1 A g-1, a reversible capacity of 171.5 mA h g-1 is retained, showcasing good stability and a significantly higher capacity compared to TCBp-1100. This study introduces novel approaches for the high-value utilization of solid-phase by-products from waste tires, offering certain economic benefits, and contributes fresh insights into the advancement of SIBs anodes. © 2024, The Authors. All rights reserved.

关键词： Graphene

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