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极化子离域对LiNiMnCoO中电输运影响的证据。

Evidence for the influence of polaron delocalization on the electrical transport in LiNiMnCoO.

作者信息

Feng Tao, Li Liping, Shi Quan, Dong Shengde, Li Baoyun, Li Ke, Li Guangshe

机构信息

State Key Laboratory of Inorganic Synthesis and Preparative Chemistry, College of Chemistry, Jilin University, Changchun 130012, P. R. China.

Thermochemistry Laboratory, Liaoning Province Key Laboratory of Thermochemistry for Energy and Materials, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian 116023, P. R. China.

出版信息

Phys Chem Chem Phys. 2020 Jan 28;22(4):2054-2060. doi: 10.1039/c9cp05768d. Epub 2020 Jan 6.

Abstract

Polaron delocalization in layered transition-metal oxides can considerably impact their physical properties and technological applications. Herein, we present the evidence for the influence of polaron delocalization on the electrical transport of layered oxides LiNiMnCoO, an active cathode material, by controlling the chemical compositions. We find that the chemical composition at x = 0.3 exhibits a sharp increment in electronic conductivity of four orders of magnitude at room temperature with respect to that at x = 0. We attribute the increased electronic conductivity to a low hopping energy in addition to a weak electron-phonon interaction. The weakened electron-phonon interaction is the source of polaron delocalization in LiNiMnCoO, which became improved with increasing x due to the increased polaron sizes. Moreover, it is also suggested that the polaron delocalization may have a relationship with the strong Jahn-Teller distortion induced by Ni. The analysis of temperature dependent electrical transport within the framework of the small polaron hopping conduction model enables us to comprehend the influence of polaron delocalization on the electrical transport pertinent to the applications of layered oxide materials.

摘要

层状过渡金属氧化物中的极化子离域化会对其物理性质和技术应用产生重大影响。在此,我们通过控制化学成分,给出了极化子离域化对层状氧化物LiNiMnCoO(一种活性阴极材料)的电输运影响的证据。我们发现,相对于x = 0时,x = 0.3处的化学成分在室温下电子电导率急剧增加了四个数量级。我们将电子电导率的增加归因于低跳跃能以及弱电子 - 声子相互作用。减弱的电子 - 声子相互作用是LiNiMnCoO中极化子离域化的来源,由于极化子尺寸增大,随着x的增加,这种离域化得到改善。此外,还表明极化子离域化可能与Ni诱导的强 Jahn - Teller 畸变有关。在小极化子跳跃传导模型框架内对温度依赖电输运的分析,使我们能够理解极化子离域化对与层状氧化物材料应用相关的电输运的影响。

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