X-ray Absorption Near Edge Structure (XANES) Spectrum Interpretation for LiFePO4-Silicon Doped Cathode Material

S. H. Intifadhah, Kholis Nurhanafi, F. Astuti, R. Munir, D. Hamdani, D. Darminto
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Abstract

LiFePO4-Silicon doped has been widely developed as a battery cathode material. Due to the doping of silicon atoms, this study aims to determine the peak energy (E0), oxidation state and percentage of component composition for Fe K-edge. The experimental sample used are LFP Si-0%, LFP Si-1%, LFP Si-3% and LFP Si-6%. These samples were characterized using XAS (X-ray Absorption Spectroscopy). XANES spectrum showed the peak energy of Pre-edge area is 7113.08 – 7114.49 eV. The oxidation state of Fe atoms were increased and tend to be Fe3+ than Fe2+. Moreover, Linear Combination Fitting (LCF) used to determine the ratio composition FeO/Fe2O3 in experimental samples. The ratio composition indicated Fe atom is multivalent, when the percentage of silicon-doped increases, the ratio of Fe3+ increased.It has been found that the presence of silicon atoms in the LiFePO4 structure has an effect in electronic structure.
lifepo4 -硅掺杂正极材料的x射线吸收近边结构(XANES)光谱解释
掺硅lifepo4作为电池正极材料得到了广泛的发展。由于掺杂了硅原子,本研究旨在确定Fe K-edge的峰值能(E0)、氧化态和组分组成百分比。使用的实验样品为LFP Si-0%、LFP Si-1%、LFP Si-3%和LFP Si-6%。用XAS (x射线吸收光谱)对样品进行了表征。XANES光谱显示,前边缘区域的峰值能量为7113.08 ~ 7114.49 eV。铁原子的氧化态增加,趋向于Fe3+而不是Fe2+。此外,采用线性组合拟合(LCF)确定了实验样品中FeO/Fe2O3的比例组成。比值组成表明Fe原子是多价的,随着掺硅量的增加,Fe3+的比值也随之增加。研究发现,硅原子在LiFePO4结构中的存在对其电子结构有影响。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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