Browsing by Author "Yan, Bo"

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    Characterization of dynamic morphological changes of tin anode electrode during (de)lithiation processes using in operando synchrotron transmission X-ray microscopy
    (Elsevier, 2019) Li, Tianyi; Zhou, Xinwei; Cui, Yi; Lim, Cheolwoong; Kang, Huixiao; Yan, Bo; Wang, Jiajun; Wang, Jun; Fu, Yongzhu; Zhu, Likun; Mechanical and Energy Engineering, School of Engineering and Technology
    The morphological evolution of tin particles with different sizes during the first lithiation and delithiation processes has been visualized by an in operando synchrotron transmission X-ray microscope (TXM). The in operando lithium ion battery cell was operated at constant current condition during TXM imaging. Two-dimensional projection images with 40 nm resolution showing morphological evolution were obtained and analyzed. The analysis of relative area change shows that the morphology of tin particles with different sizes changed simultaneously. This phenomenon is mainly due to a negative feedback mechanism among tin particles in the battery electrode at a constant current operating condition. For irregular-shaped tin particles, the contour analysis shows that the regions with higher curvature started volume expansion first, and then the entire particle expanded almost homogeneously. This study provides insights for understanding the dynamic morphological change and the particle-particle interactions in high capacity lithium ion battery electrodes.
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    Geometric and Electrochemical Characteristics of LiNi1/3Mn1/3Co1/3O2 Electrode with Different Calendering Conditions
    (Elsevier, 2017-04) Kang, Huixiao; Lim, Cheolwoong; Li, Tianyi; Fu, Yongzhu; Yan, Bo; Houston, Nicole; De Andrade, Vincent; De Carlo, Francesco; Zhu, Likun; Department of Mechanical Engineering, School of Engineering and Technology
    The impact of calendering process on the geometric characteristics and electrochemical performance of LiNi1/3Mn1/3Co1/3O2 (NMC) electrode was investigated in this study. The geometric properties of NMC electrodes with different calendering conditions, such as porosity, pore size distribution, particle size distribution, specific surface area and tortuosity were calculated from the computed tomography data of the electrodes. A synchrotron transmission X-ray microscopy tomography system at the Advanced Photon Source of the Argonne National Laboratory was employed to obtain the tomography data. The geometric and electrochemical analysis show that calendering can increase the electrochemically active area, which improves rate capability. However, more calendering will result in crushing of NMC particles, which can reduce the electrode capacity at relatively high C rates. This study shows that the optimum electrochemical performance of NMC electrode at 94:3:3 weight ratio of NMC:binder:carbon black can be achieved by calendering to 3.0 g/cm3 NMC density.
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    Geometric characteristics of 3D reconstructed anode electrodes of lithium ion batteries
    (Office of the Vice Chancellor for Research, 2014-04-11) Lim, Cheolwoong; Yan, Bo; Yin, Leilei; Zhu, Likun
    The realistic 3D microstructure of lithium ion battery electrodes plays a key role in studying the effects of inhomogeneous microstructures on the performance of LIBs. However, the complexity of realistic microstructures implements significant computational cost on numerical simulation of large size samples. In this work, we used tomographic data obtained for a commercial lithium ion battery graphite electrode to evaluate the geometric characteristics of the reconstructed electrode microstructure. Based on the analysis of geometric properties, such as porosity, specific surface area, tortuosity, and pore size distribution, a representative volume element that retains the geometric characteristics of the electrode material was obtained for further numerical studies. In this work, X-ray micro-CT with 0.56 μm resolution was employed to capture the inhomogeneous porous microstructures of lithium ion battery anode electrodes. The Sigmoid transform function was employed to convert the initial raw tomographic images to binary images. Moreover, geometric characteristics of an anode electrode after 2400 1 C charge/discharge cycles were compared with those of a new anode electrode to investigate morphological change of the electrode. In general, the cycled electrode shows larger porosity, smaller tortuosity, and similar specific surface area compared to the new electrode.
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    In Situ and Operando Investigation of the Dynamic Morphological and Phase Changes of Selenium-doped Germanium Electrode during (De)Lithiation Processes
    (RSC, 2020-01) Li, Tianyi; Lim, Cheolwoong; Cui, Yi; Zhou, Xinwei; Kang, Huixiao; Yan, Bo; Meyerson, Melissa L.; Weeks, Jason A.; Liu, Qi; Guo, Fangmin; Kou, Ronghui; Liu, Yuzi; De Andrade, Vincent; De Carlo, Francesco; Ren, Yang; Sun, Cheng-Jun; Mullins, C. Buddie; Chen, Lei; Fu, Yongzhu; Zhu, Likun; Mechanical and Energy Engineering, School of Engineering and Technology
    To understand the effect of selenium doping on the good cycling performance and rate capability of a Ge0.9Se0.1 electrode, the dynamic morphological and phase changes of the Ge0.9Se0.1 electrode were investigated by synchrotron-based operando transmission X-ray microscopy (TXM) imaging, X-ray diffraction (XRD), and X-ray absorption spectroscopy (XAS). The TXM results show that the Ge0.9Se0.1 particle retains its original shape after a large volume change induced by (de)lithiation and undergoes a more sudden morphological and optical density change than pure Ge. The difference between Ge0.9Se0.1 and Ge is attributed to a super-ionically conductive Li–Se–Ge network formed inside Ge0.9Se0.1 particles, which contributes to fast Li-ion pathways into the particle and nano-structuring of Ge as well as buffering the volume change of Ge. The XRD and XAS results confirm the formation of a Li–Se–Ge network and reveal that the Li–Se–Ge phase forms during the early stages of lithiation and is an inactive phase. The Li–Se–Ge network also can suppress the formation of the crystalline Li15Ge4 phase. These in situ and operando results reveal the effect of the in situ formed, super-ionically conductive, and inactive network on the cycling performance of Li-ion batteries and shed light on the design of high capacity electrode materials.
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    Polarization Analysis Based on Realistic Lithium Ion Battery Electrode Microstructure Using Numerical Simulation
    (Office of the Vice Chancellor for Research, 2015-04-17) Yan, Bo; Lim, Cheolwoong; Song, Zhibin; Zhu, Likun
    The performance of lithium ion battery (LIB) is limited by the inner polarization and it is important to understand the factors that affect the polarization. This study focuses on the polarization analysis based on realistic 3D electrode microstructures. A c++ software was developed to rebuild and mesh the microstructure of cathode and anode electrodes through Nano-CT and Micro-CT scanned images respectively. As a result, the LIB model was composed of electrolyte, cathode and anode active materials and current collectors. By employing 3D finite volume method (FVM), another c++ code was developed to simulate the discharge and charge processes by solving coupled model equations. The simulation revealed the distribution of physical and electrochemical variables such as concentration, voltage, current density, reaction rate, et al. In order to explore the correlation of local effects and electrode structural heterogeneity, the cathode electrode were divided equally into 8 sub-divisions, of which the porosity, tortuosity, specific surface area were calculated. We computed the polarizations in the sub-divisions due to different sub-processes, i.e., the activation of electrochemical reactions and charge transport of species. As shown in Fig. 1, the tortuosity is very irregular because of unevenly distributed cathode particle size and packing pattern with low porosity. There are no exact and direct relations among porosity, tortuosity and specific surface area. Fig. 2 shows that the polarizations are related to the porosity in sub-divisions. The knowledge from the study will help to figure out the mechanism of polarization and power loss in LIB, which could be useful to improve LIB design and manufacturing. Acknowledgments: This work was supported by US National Science Foundation under Grant No. 1335850. Fig. 1 Porosity and tortuosity in sub-divisions of a cathode electrode Fig. 2 Intercalation reaction polarization and ionic conduction polarization of sub-divisions at 120 sec during a 5 C charging process
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    Simulation of Heat Generation in a Reconstructed LiCoO2 Cathode during Galvanostatic Discharge
    (Office of the Vice Chancellor for Research, 2014-04-11) Yan, Bo; Song, Zhibin; Lim, Cheolwoong; Zhu, Likun
    A three dimensional numerical framework with finite volume method was employed to simulate heat generation of a semi lithium ion battery (LIB) cell during isothermal galvanostatic discharge processes. The microstructure of the LIB cathode electrode was experimentally determined using X-ray nano computed tomography technology. Heat generation in the semi LIB cell during galvanostatic discharge processes from different mechanisms, such as electronic resistive heat, ionic resistive heat, contact resistive heat, reaction heat, entropic heat and heat of mixing, was investigated. The spatial distribution of heat generation rates from different mechanisms was also studied. The simulation results demonstrate that the magnitude of heat generation rates spans a wide range in the electrode due to structural inhomogeneity. The simulation results of heat generation from the three dimensional model and the porous-electrode theory model were compared in this study. It is found that the typical Bruggeman coefficient, 1.5, underestimated ionic resistance in the electrolyte and overestimated electronic resistance in the cathode particles. In general, the three dimensional model predicted more heat generation than the porous-electrode theory model at large discharge rates due to the wider distribution of physical and electrochemical properties.
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    Three-Dimensional Reconstruction and Analysis of All-Solid Li-Ion Battery Electrode Using Synchrotron Transmission X-ray Microscopy Tomography
    (ACS, 2018-05) Li, Tianyi; Kang, Huixiao; Zhou, Xinwei; Lim, Cheolwoong; Yan, Bo; De Andrade, Vincent; De Carlo, Francesco; Zhu, Likun; Mechanical Engineering, School of Engineering and Technology
    A synchrotron transmission X-ray microscopy tomography system with a spatial resolution of 58.2 nm at the Advanced Photon Source was employed to obtain three-dimensional morphological data of all-solid Li-ion battery electrodes. The three-phase electrode was fabricated from a 47:47:6 (wt %) mixture of Li(Ni1/3Mn1/3Co1/3)O2 as active material, Li1.3Ti1.7Al0.3(PO4)3 as Li-ion conductor, and Super-P carbon as electron conductor. The geometric analysis show that particle-based all-solid Li-ion battery has serious contact interface problem which significantly impact the Li-ion transport and intercalation reaction in the electrode, leading to low capacity, poor rate capability and cycle life.