Study of Alternative Current Conduction Mechanisms on the α-LiFeO2-Based Cathode Materials

IF 3.7 2区 化学 Q2 CHEMISTRY, APPLIED
Abdulaziz Abdulmohsen Alnafea, Narimen Chakchouk, Hala Siddiq, Saleh M. Altarifi, Mohamed Houcine Dhaou, Abdallah Ben Rhaiem
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Abstract

An improved solid-state synthesis method was used to create LiFeO2 layered oxides. The produced material adopts a cubic system (Fm-3m space group) with a refined cell parameter of a = 4.156(9) Å, as indicated by Rietveld refinement of the crystal structure. A morphological investigation revealed that the sample is composed of small primary particles with sizes ranging from 0.20 to 0.75 μm. IR spectroscopy vibrational analysis revealed the presence of FeO6 and LiO6 groups. The compound's semiconductor nature was confirmed when the band gap energy was generated and discovered to be 2 eV. There is a tighter dispersion of localized states within the band gap, as indicated by the obtained Urbach energy (0.39 eV), which presents just 20% from the band gap energy. The material's dielectric characteristics were assessed between 0.1 and 107 Hz in frequency and between 333 K and 523 K in temperature. The presence of both space charge and dipolar polarization is suggested by the real component of the dielectric permittivity, which indicates a high dielectric constant (between 100 and 350) at low frequency. The circuits are made up of constant phase elements (CPE) and bulk resistance R coupled in parallel. Jonscher's law was applied to interpret the frequency-dependent conductivity. The outcomes of the charge transport investigation on LiFeO2 imply that the layered oxide material possessed a large polaron tunneling (OLPT) paradigm with activation energy Ea of 0.26 eV. Comparing the polaron Rω (2 < Rω < 5 Å) optimal hopping length to the Li–O interatomic gap (2.077(9) Å), it is larger. We identified and examined a correlation between the ionic conductivity and the crystal structure.

Abstract Image

α- lifeo2基正极材料的交流电传导机理研究
采用改进的固态合成方法制备了LiFeO2层状氧化物。所得材料采用立方体系(Fm-3m空间群),细化晶胞参数a = 4.156(9) Å,由晶体结构的Rietveld细化可知。形貌分析表明,样品由0.20 ~ 0.75 μm大小的初级颗粒组成。红外光谱振动分析表明,材料中存在FeO6和LiO6基团。当产生带隙能量时,化合物的半导体性质得到证实,并发现其为2ev。得到的乌尔巴赫能量(0.39 eV)仅占带隙能量的20%,表明局域态在带隙内的色散更为紧密。材料的介电特性在0.1 ~ 107 Hz频率和333 ~ 523 K温度范围内进行了评估。电介质介电常数的实分量表明了空间电荷和偶极极化的存在,这表明低频时的介电常数很高(在100到350之间)。该电路由恒相元件(CPE)和体电阻R并联组成。Jonscher定律被用来解释频率相关的电导率。LiFeO2的电荷输运研究结果表明,层状氧化材料具有较大的极化子隧穿(OLPT)模式,活化能Ea为0.26 eV。将极化子Rω (2 < Rω < 5 Å)的最优跳变长度与Li-O原子间间隙(2.077(9)Å)比较,其更大。我们确定并检查了离子电导率和晶体结构之间的相关性。
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来源期刊
Applied Organometallic Chemistry
Applied Organometallic Chemistry 化学-无机化学与核化学
CiteScore
7.80
自引率
10.30%
发文量
408
审稿时长
2.2 months
期刊介绍: All new compounds should be satisfactorily identified and proof of their structure given according to generally accepted standards. Structural reports, such as papers exclusively dealing with synthesis and characterization, analytical techniques, or X-ray diffraction studies of metal-organic or organometallic compounds will not be considered. The editors reserve the right to refuse without peer review any manuscript that does not comply with the aims and scope of the journal. Applied Organometallic Chemistry publishes Full Papers, Reviews, Mini Reviews and Communications of scientific research in all areas of organometallic and metal-organic chemistry involving main group metals, transition metals, lanthanides and actinides. All contributions should contain an explicit application of novel compounds, for instance in materials science, nano science, catalysis, chemical vapour deposition, metal-mediated organic synthesis, polymers, bio-organometallics, metallo-therapy, metallo-diagnostics and medicine. Reviews of books covering aspects of the fields of focus are also published.
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