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Home > Archive>Volume 51, Issue 2, 2022 >442-451. DOI:10.12442/j.issn.1002-185X.20200963
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Estimation of Thermodynamic Properties of Li1+x M 1-xO2 Cathode Material for Lithium-Ion Battery (Lithium-Rich) Based on the Group Contribution Method
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Affiliation:

1.State Key Laboratory of Advanced Processing and Recycling of Nonferrous Metals, Lanzhou University of Technology, Lanzhou 730050, China;2.College of Science, Lanzhou University of Technology, Lanzhou 730050, China

Fund Project:

National Natural Science Foundation of China (51864032); Joint Fund Between Shenyang National Laboratory for Materials Science and State Key Laboratory of Advanced Processing and Recycling of Nonferrous Metals (18LHZD002)

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    Abstract:

    Given the lack of thermodynamic data on Li1+xM1-xO2 materials, LiAlO2 was split in accordance with the principle of the group contribution method. Mathematical models for estimating the ?Gθf,298, ?Hθf,298, and Cp of LiAlO2 were proposed on the basis of thermodynamic principles. The group contribution method was used to estimate the ?Gθf,298, and ?Hθf,298 of 56 solid inorganic compounds and the Cp,298 of 54 solid inorganic compounds to test the reliability and applicability of the model. The group contribution method was used to estimate the mathematical model of solid inorganic compounds. Results show that the experimental data selected by fitting group parameters are accurate and reliable, and the group division method is appropriate. Mathematical models for estimating the ?Gθf,298, ?Hθf,298, and Cp of three types of Li1+xM1-xO2 materials were constructed on the basis of the satisfactory results. The ?Gθf,298, ?Hθf,298, and Cp,298 of the 63 common Li1+xM1-xO2 materials were also estimated.

    Reference
    [1] Han Chen, Cao Wenqiang, Cao Maosheng. Inorg Chem Front[J], 2020, 21(7): 4101
    [2] Cao Maosheng, Wang Xixi, Cao Wenqiang et al. Small[J], 2018, 14(29): 1 800 987
    [3] Cao Wenqiang, Wang Wenzhong, Shi Honglong et al. Nano Res[J], 2018, 11(3): 1437
    [4] Cao Maosheng, Wang Xixi, Zhang Min et al. Adv Funct Mater[J], 2019, 29(25): 1 807 398
    [5] Hassoun J, Lee K S, Sun Y K et al. Journal of the American Chemical Society[J], 2011, 133(9): 3139
    [6] Li Hong. Energy Storage Science and Technology[J], 2015, 4(3): 306 (in Chinese)
    [7] Etacheri V, Marom R, Elazari R et al. Energy Environ Sci[J], 2011, 4(9): 3243
    [8] Thackeray M M, Kang S H, Johnson C S et al. Journal of Materials Chemistry[J], 2007, 17(30): 3112
    [9] Zhang Lianqi, Ren Libin, Liu Xingjiang et al. Chinese Journal of Power Sources[J], 2009, 33(5): 426 (in Chinese)
    [10] Yao Lihua, Cao Wenqiang, Cao Maosheng et al. Chemical Engineering Journal[J], 2021, 413: 127 428
    [11] Lu Z, Beaulieu L Y, Donaberger R A et al. Journal of the Electrochemical Society[J], 2002, 149(6): 778
    [12] Boulineau A, Croguennec L, Delmas C et al. Chemistry of Materials[J], 2009, 21(18): 4216
    [13] Armstrong A R, Holzapfel M, Novák P et al. Journal of the American Chemical Society[J], 2006, 128(26): 8694
    [14] Kim J S, Johnson C S, Vaughey J T et al. Chemistry of Materials[J], 2004, 16(10): 1996
    [15] Kang S H, Amine K. Journal of Power Sources[J], 2005, 146(1): 654
    [16] Wei X, Zhang S, Du Z et al. Electrochimica Acta[J], 2013, 107: 549
    [17] Shi S J, Tu J P, Tang Y Y et al. Journal of Power Sources[J], 2013, 228: 14
    [18] Peng Qingwen, Liu Xingjiang. Chinese Journal of Power Sources[J], 2017(9): 1248 (in Chinese)
    [19] Wang Zhao, Wu Feng, Su Yuefeng et al. Acta Physico-Chimica Sinica[J], 2012, 28(4): 823
    [20] He Wei, Qian Jiangfeng, Cao Yuliang et al. RSC Advances[J], 2012, 2(8): 3423
    [21] Jarvis K A, Deng Z, Allard L F et al. Chemistry of Materials[J], 2011, 23(16): 3614
    [22] Lee D K, Park S H, Amine K et al. Journal of Power Sources[J], 2006, 162(2): 1346
    [23] Kim J H, Park C W, Sun Y K. Solid State Ionics[J], 2003, 164(1): 43
    [24] Arunkumar T A, Wu Y, Manthiram A. Chemistry of Materials[J], 2007, 19(12): 3067
    [25] Wang Q Y, Liu J, Murugan A V et al. Journal of Materials Chemistry[J], 2009, 19(28): 4965
    [26] Yabuuchi N, Yoshii K, Myung S T et al. Journal of the American Chemical Society[J], 2011, 133(12): 4404
    [27] Mostafa A T M G, Eakman J M, Yarbro S L. Guizhou Chemical Industry[J], 1997, 34(12): 4577 (in Chinese)
    [28] Mostafa A T M G, Eakman J M, Montoya M M et al. Industrial & Engineering Chemistry Research[J],1996, 35(1): 343
    [29] Dean J A. Lange's Handbook of Chemistry[M]. Beijing: Science Press, 2003: 977
    [30] Leitner J, Chuchvalec P, Sedmidubsky D et al. Thermochimica Acta[J], 2002, 395(1): 27
    [31] Yang Lixin, Wang Dahui, Chen Huaijing et al. Rare Metal Materials and Engineering[J], 2020, 49(1): 161 (in Chinese)
    [32] Lixin Yang, Dahui Wang, Huaijing Chen et al. Rare Metals[J], 2020, 44(10): 1053 (in Chinese)
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[Wang Dahui, Gan Xianhao, Chen Huaijing, Yang Lixin, Hu Pingping, Liu Zhenning. Estimation of Thermodynamic Properties of Li1+x M 1-xO2 Cathode Material for Lithium-Ion Battery (Lithium-Rich) Based on the Group Contribution Method[J]. Rare Metal Materials and Engineering,2022,51(2):442~451.]
DOI：10.12442/j. issn.1002-185X.20200963

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History
  • Received:December 15,2020
  • Revised:February 03,2021
  • Adopted:March 08,2021
  • Online: March 03,2022
  • Published: February 28,2022

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