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脱锂态LixCoO2(0.5<x<1)的晶体结构

Crystal structure of delithiated LixCoO2 (0.5<x<1)

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【作者】 闫时建刘鑫仇卫华田文怀

【Author】 YAN Shijian, LIU Xin, QIU Weihua, TIAN WenhuaiMaterials Science and Engineering School, University of Science and Technology Beijing, Beijing 100083, China

【机构】 北京科技大学材料科学与工程学院北京科技大学材料科学与工程学院 北京100083北京100083

【摘要】 研究了随锂离子的脱出,锂离子电池正极材料LixCoO2(0·5<x<1)晶体结构的变化.对高温合成的LiCoO2用强氧化剂NaS2O8化学抽取锂离子,得到几种不同锂含量的脱锂态LixCoO2,并使用X射线衍射和电子衍射进行晶体结构分析.X射线衍射结果表明,在0·5<x<1范围内LixCoO2晶胞参数c发生变化.电子衍射结果表明,脱锂态的LixCoO2(0·5<x<1)中发生了X射线衍射检测不到的锂离子/空位有序排列的相变,从而使晶体结构显著变化,并给出了相应的晶体结构模型.相变在以LiCoO2为电极的电池充放电曲线上表现为电压平台.

【Abstract】 The crystal structure change of LixCoO2 (0.5<x<1) during delithiating process was studied in order to optimize the electrochemical property of the Li-ion battery cathode material LiCoO2. LixCoO2 samples with different lithium contents were prepared by chemically extracting lithium from LiCoO2 with Na2S2O8. The crystal structures of these samples were then analyzed by X-ray diffraction and electron diffraction. From X-ray diffraction, the lattice parameter c of LixCoO2 (0.5<x<1) changes with Li content. The results of electron diffraction indicate that the ordered arrangement of lithium and vacancy in LixCoO2 (0.5<x<1) which cannot be detected by XRD leads to significant change in crystal structure and the corresponding crystal structure model was proposed. Phase transformation exhibits voltage plateau in the charge and discharge curves of a Li-ion battery with LiCoO2 cathode.

【基金】 国家信息产业部基金资助项目(No.0204ZM0046)
  • 【文献出处】 北京科技大学学报 ,Journal of University of Science and Technology Beijing , 编辑部邮箱 ,2007年01期
  • 【分类号】TM912
  • 【被引频次】12
  • 【下载频次】315
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