论文标题

锂离子电池的2D-XAS图像的非负基质分解

Non-Negative Matrix Factorization for 2D-XAS Images of Lithium Ion Batteries

论文作者

Tanimoto, Hiroki, Hongkun, Xu, Mizumaki, Masaishiro, Seno, Yoshiki, Uchiwada, Jumpei, Yamagami, Ryo, Kumazoe, Hiroyuki, Iwamitsu, Kazunori, Kimura, Yuta, Amezawa, Koji, Akai, Ichiro, Aonishi, Toru

论文摘要

锂离子二级电池已用于多种用途,例如为移动设备和电动汽车供电,但应提高其性能。限制其性能的因素之一是在充电和放电过程中化学反应的不均匀性。已经尝试了许多尝试阐明这种反应不均匀性背后的机制。在本文中,为了检测来自锂离子电池的CO K-边缘二维X射线吸收光谱(2D-XAS)图像的各种物理性质的不均匀性,我们提出了一种由单侧正交非对异构基质分解组成的方法。在电池中不同位置获得的X射线吸收光谱之间的差异很小。但是,即使在这种情况下,我们的方法也可以将2D-XAS数据分解为不同的空间域及其相应的吸收光谱。从获得的吸收光谱的光谱分解中,我们证实了主要峰的过渡 - 能量转移,作为电荷状态变化的证据,并发现了由于分解光谱成分中轨道杂交引起的光谱变化。

Lithium-ion secondary batteries have been used in a wide variety of purposes, such as for powering mobile devices and electric vehicles, but their performance should be improved. One of the factors that limits their performance is the non-uniformity of the chemical reaction in the process of charging and discharging. Many attempts have been made to elucidate the mechanism behind this reaction non-uniformity. In this paper, to detect non-uniformity in various physical properties from Co K-edge two-dimensional X-ray absorption spectroscopy (2D-XAS) images of lithium ion batteries, we propose a method that consists of one-sided orthogonal non-negative matrix factorization in combination with removal of the reference signal. The difference between X-ray absorption spectra acquired at different positions in the battery is very small. However, even in such a situation, our method can decompose the 2D-XAS data into different spatial domains and their corresponding absorption spectra. From the spectral decomposition of the obtained absorption spectra, we confirmed a transition-energy shift of the main peak as evidence for a change in the state of charge and also found spectral changes due to orbital hybridization in the decomposed spectral components.

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