局域结构优化Li-Ni-Te-O正极的电化学可逆性

doi:10.3969/j.issn.0253-2778.2019.04.001

中国科学技术大学学报 ›› 2019, Vol. 49 ›› Issue (4): 259-267.DOI: 10.3969/j.issn.0253-2778.2019.04.001

• 论著 • 下一篇

局域结构优化Li-Ni-Te-O正极的电化学可逆性

齐家新，王星博，苏晓智，解晖，REHMANZiaur，陶石，储旺盛

1.中国科学技术大学国家同步辐射实验室，安徽合肥 230026；2.中国科学院上海应用物理研究所上海光源，上海 201204; 3.常熟理工学院物理与电子工程学院，江苏常熟 215500

收稿日期:2018-03-01 修回日期:2018-05-22 接受日期:2018-05-22 出版日期:2019-04-30 发布日期:2018-05-22

Improved electrochemical reversibility of Li-Ni-Te-O cathode by local domain structure optimization

QI Jiaxin, WANG Xingbo, SU Xiaozhi2, XIE Hui, REHMAN Zia ur, TAO Shi3, CHU Wangsheng

Received:2018-03-01 Revised:2018-05-22 Accepted:2018-05-22 Online:2019-04-30 Published:2018-05-22
Contact: CHU Wangsheng
About author:QI Jiaxin, male, born in 1991, master. Research field: energy storage and conversion material. E-mail: qjiaxin@mail.ustc.edu.cn
Supported by:
Supported by the National Natural Science Foundation of China (11275227, U1632103).

摘要/Abstract

摘要： 利用固相法合成了一系列化合物Li1+xNi3/4-5/4xTe1/4+1/4xO2 (x=0, 0.14, 0.33, 0.46, 0.50和 0.60).在x=0.33时，发现C2/m晶体结构中存在一种新奇的围绕Ni离子的短程有序P1-like区域，此区域表现出一种松散结合的局域结构以及更快的Li+迁移率，进而保证了优越的结构和电化学可逆性.通过非原位X射线吸收谱（XAS）、X射线衍射（XRD）、X射线光电子能谱(XPS)和电化学表征研究了材料的性能.证明了这种性能与稳定的短程-长程有序结构以及Ni氧化还原电子对有关.该研究提供了发展高性能富锂正极材料的新思路.

关键词: 锂离子电池, 正极材料, 局域结构

Abstract: Novel layered oxide Li1+xNi3/4-5/4xTe1/4+1/4xO2 (x=0, 0.14, 0.33, 0.46, 0.50 and 0.60) cathodes were synthesized by a solid-state reaction method. A unique P1-like domain with a short-range order around Ni ions was found in the monoclinic C2/m crystal with x=0.33, which displays a loosely bonded local structure and increased Li+ mobility, enabling superior structural as well as electrochemical reversibility. The enhanced properties investigated by ex situ X-ray absorption spectroscopy (XAS), X-ray diffraction (XRD), X-ray photoelectron spectroscopy (XPS) and electrochemical characterization were corroborated to originate from the stable short- and long-range ordering structure along with the Ni electron redox. This study may open up new avenues for the development of Li-rich cathode materials with sufficiently good performance.

Key words: Li-ion battery, cathode material, local structure

中图分类号:

O646.21

齐家新，王星博，苏晓智，解晖，REHMANZiaur，陶石，储旺盛. 局域结构优化Li-Ni-Te-O正极的电化学可逆性[J]. 中国科学技术大学学报, 2019, 49(4): 259-267.

参考文献

［1］
JANSE A N , KAHAIAN A J, KEPLE K D, et al. Development of a high-power lithium-ion battery [J]. Journal of Power Sources, 1999, 81: 902-905.
[2] SMITH K, WANG C Y. Power and thermal characterization of a lithium-ion battery pack for hybrid-electric vehicles [J]. Journal of Power Sources, 2006, 160(1): 662-673.
[3] ARMAND M, TARASCON J M. Building better batteries [J]. Nature, 2008, 451(7179): 652-657.
[4] THACKERAY M M, WOLVERTON C, ISAACS E D. Electrical energy storage for transportation-approaching the limits of, and going beyond, lithium-ion batteries [J]. Energy & Environmental Science, 2012, 5(7): 7854-7863.
[5] MIZUSHIMA K, JONES P C, WISEMAN P J, et al. LixCoO2 (0 <x≤1) : A new cathode material for batteries of high-energy density [J]. Solid State Ionics, 1981, 3-4: 171-174.
[6] OHZUKU T, UEDA A, NAGAYAMA M, et al. Comparative-study of LiCoO2, LiNi1/2Co1/2O2 and LiNiO2 for 4-volt secondary lithium cells [J]. Electrochim Acta,1993, 38(9): 1159-1167.
[7] KOKSBANG R, BARKER J, SHI H, et al. Cathode materials for lithium rocking chair batteries [J]. Solid State Ionics, 1996, 84(1/2): 1-21.
[8] LU X, SUN Y, JIAN Z L, et al. New insight into the atomic structure of electrochemically delithiated O3-Li1-xCoO2 (0 ≤x≤0.5) nanoparticles [J]. Nano Letters, 2012, 12(12): 6192-6197.
[9] LIU W, OH P, LIU X, et al. Nickel-rich layered lithium transition-metal oxide for high-energy lithium-ion batteries [J]. Angew Chem Int Ed, 2015, 54(15): 4440-4457.
[10] OHZUKU T, MAKIMURA Y. Layered lithium insertion material of LiNi1/2Mn1/2O2: A possible alternative to LiCoO2 for advanced lithium-ion batteries [J]. Chemistry Letters, 2001, 8: 744-745.
[11] YOON W S, GREY C P, BALASUBRAMANIAN M, et al. In situ X-ray absorption spectroscopic study on LiNi0.5Mn0.5O2 cathode material during electrochemical cycling [J]. Chemistry of Materials, 2003, 15(16): 3161-3169.
[12] YABUUCHI N, OHZUKU T. Novel lithium insertion material of LiCo1/3Ni1/3Mn1/3O2 for advanced lithium-ion batteries [J]. Journal of Power Sources, 2003, 119: 171-174.
[13] XU J, LIN F, NORDLUND D, et al. Elucidation of the surface characteristics and electrochemistry of high-performance LiNiO2 [J]. Chemical Communications, 2016, 52(22): 4239-4242.
[14] DELMAS C, PERES J P, ROUGIER A, et al. On the behavior of the LixNiO2 system: An electrochemical and structural overview [J]. Journal of Power Sources, 1997, 68(1): 120-125.
[15] SHIN D, WOLVERTON C, CROY J, et al. First-principles calculations, electrochemical and X-ray absorption studies of Li-Ni-PO4 surface-treated xLi2MnO3·(1-x)LiMO2 (M= Mn, Ni, Co) electrodes for Li-ion batteries [J]. Journal of The Electrochemical Society, 2011, 159(2): A121-A127.
[16] SUN Y K, CHEN Z H, NOH H J, et al. Nanostructured high-energy cathode materials for advanced lithium batteries [J]. Nature Materials, 2012, 11(11): 942-947.
[17] MA X H, KANG K S, CEDER G, et al. Synthesis and electrochemical properties of layered LiNi2/3Sb1/3O2 [J]. Journal of Power Sources, 2007, 173(1): 550-555.
[18] YABUUCHI N, TAHARA Y, KOMABA S, et al. Synthesis and electrochemical properties of Li4MoO5-NiO binary system as positive electrode materials for rechargeable lithium batteries [J]. Chemistry Of Materials, 2016, 28(2): 416-419.
[19] LAHA S, NATARAJAN S, GOPALAKRISHNAN J, et al. Oxygen-participated electrochemistry of new lithium-rich layered oxides Li3MRuO5 (M = Mn, Fe) [J]. Physical Chemistry Chemical Physics, 2015, 17(5): 3749-3760.
[20] MORET J, DANIEL F, LOEKSMANTO W, et al. Structure cristalline d'un oxotellurate, Li4TeviO5, à groupement anionique individualisé: Te2viO108- [J]. Acta Crystallographica Section B, 1978, 34(11): 3156-3160.
[21] HEYMANN G, SELB E, KOGLER M, et al. Li3Co1.06(1)TeO6: Synthesis, single-crystal structure and physical properties of a new tellurate compound with CoII/CoIII mixed valence and orthogonally oriented Li-ion channels[J]. Dalton Transactions, 2017, 46(37): 12663-12674.
[22] GUPTA A, KUMAR V, UMA S. Interesting cationic (Li+/Fe3+/Te6+) variations in new rocksalt ordered structures [J]. Journal of Chemical Sciences, 2015, 127(2): 225-233.
[23] MCCALLA E, PRAKASH A S, BERG E, et al. Reversible Li-intercalation through oxygen reactivity in Li-rich Li-Fe-Te oxide materials [J]. Journal of the Electrochemical Society, 2015, 162(7): A1341-A1351.
[24] ZVEREVA E A, NALBANDYAN V B, EVSTIGNEEVA M A, et al. Magnetic and electrode properties, structure and phase relations of the layered triangular-lattice tellurate Li4NiTeO6 [J]. Journal of Solid State Chemistry, 2015, 225: 89-96.
[25] SATHIYA M, RAMESHA K, ROUSSE G, et al. Li4NiTeO6 as a positive electrode for Li-ion batteries [J]. Chemical Communications, 2013, 49(97): 11376-11378.
[26] ARUNKUMAR P, JEONG W J, WON S, et al. Improved electrochemical reversibility of over-lithiated layered Li2RuO3 cathodes: Understanding aliovalent Co3+ substitution with excess lithium [J]. Journal of Power Sources, 2016, 324: 428-438.
[27] UNTENECKER H, HOPPE R. Ein neues oxotellurat, Na4TeO5, und eine revision der struktur von Li4TeO5 [J]. Journal of the Less Common Metals, 1987,132(1):79-92.
[28] KANG K, CEDER G. Factors that affect Li mobility in layered lithium transition metal oxides [J]. Physical Review B, 2006, 74(9) : 094105.
[29] URBAN A, LEE J, CEDER G. The configurational space of rocksalt-type oxides for high-capacity lithium battery electrodes [J]. Advanced Energy Materials, 2014, 4(13)：13072-13072.
[30] BAO J, WU D, TANG Q, et al. First-principles investigations on delithiation of Li4NiTeO6 [J]. Physical Chemistry Chemical Physics, 2014,16(30): 16145-16149.
[31] HUANG W, TAO S, ZHOU J, et al. Phase separations in LiFe1-xMnxPO4: A random stack model for efficient cathode materials [J]. The Journal of Physical Chemistry C, 2013, 118(2): 796-803.
[32] YABUUCHI N, LU Y C, MANSOUR A N, et al. The influence of heat-treatment temperature on the cation distribution of LiNi0.5Mn0.5O2 and its rate capability in lithium rechargeable batteries [J]. Journal of The Electrochemical Society, 2011,158(2):A192-A200.
[33] YABUUCHI N, YOSHII K, MYUNG S T, et al. Detailed studies of a high-capacity electrode material for rechargeable batteries, Li2MnO3- LiCo1/3Ni1/3Mn1/3O2[J]. Journal of the American Chemical Society, 2011, 133(12): 4404-4419.
[34] HONG J, LIM H D, LEE M, et al. Critical role of oxygen evolved from layered Li-excess metal oxides in lithium rechargeable batteries [J]. Chemistry of Materials, 2012, 24(14): 2692-2697.

()
()

[1]	徐文军，胡芃. 基于电化学-热耦合模型的21700型锂离子电池充放电过程热行为分析[J]. 中国科学技术大学学报, 2020, 50(5): 645-653.
[2]	吴桂贤，赵海峰，黄伟峰，陶石，张凌铭，余蓁，储旺盛，韦世强. 基于同步辐射的X射线吸收谱探讨LiFexMn1-xO2的精细结构[J]. 中国科学技术大学学报, 2017, 47(5): 369-376.
[3]	黄涛，李晓娜，杨则恒. 多孔氧化镍纳米颗粒的制备及其电化学性能研究[J]. 中国科学技术大学学报, 2017, 47(5): 385-391.
[4]	张猛，陶石，黄伟峰，宋礼，吴自玉，储旺盛. 从头计算确定FeAs超导层能够作为锂离子电池的新型负极材料[J]. 中国科学技术大学学报, 2015, 45(5): 353-358.
[5]	钟国彬，苏伟，刘世念，臧永，陈春华. 基于尖晶石正极材料的柔性锂离子电池的制备和测试[J]. 中国科学技术大学学报, 2013, 43(2): 151-155.
[6]	姚晓林，张承平，陈春华. LiNixMn2-xO4对锂离子电池材料 LiCoO2的表面改性研究[J]. 中国科学技术大学学报, 2009, 39(4): 375-379.

局域结构优化Li-Ni-Te-O正极的电化学可逆性

Improved electrochemical reversibility of Li-Ni-Te-O cathode by local domain structure optimization

PDF (PC)

可视化

摘要/Abstract

引用本文

使用本文

参考文献

相关文章 6

编辑推荐

Metrics

本文评价