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作者:

Guo, Gencai (Guo, Gencai.) | Wang, Changhao (Wang, Changhao.) | Luo, Siwei (Luo, Siwei.) | Ming, Bangming (Ming, Bangming.) | Wang, Bingrong (Wang, Bingrong.) | Wang, Ruzhi (Wang, Ruzhi.) (学者:王如志)

收录:

EI SCIE

摘要:

The potential of C3N nanoribbons used as anode material for lithium-ion batteries has been systematically investigated through first-principles calculations. The results suggest that C3N nanoribbons have excellent mechanical properties (stiffness ranging from 286.28 to 412.69 Nm(-1)) and good electronic conductivity (with a bandgap of 0-0.31 eV). Further studies reveal that the H-passivated C3N nanoribbons have high Li insertion capacity (708.60 mAhg(-1)) and significantly enhanced Li binding strength (0.21-2.11 eV) without the sacrifice of Li mobility. The high stiffness, superior cycle performance, good electronic conductivity, and excellent Li migration capability indicate the great potential of C3N nanoribbons to be an anode material. The calculated results provide the valuable insights for the development of high-performance C3N nanoribbons electrode materials in lithium-ion batteries. (C) 2020 Elsevier B.V. All rights reserved.

关键词:

C3N First-principles calculations Li-ion batteries Nanoribbons

作者机构:

  • [ 1 ] [Guo, Gencai]Beijing Univ Technol, Coll Mat Sci & Engn, Key Lab Adv Funct Mat, Educ Minist China, Beijing 100124, Peoples R China
  • [ 2 ] [Wang, Changhao]Beijing Univ Technol, Coll Mat Sci & Engn, Key Lab Adv Funct Mat, Educ Minist China, Beijing 100124, Peoples R China
  • [ 3 ] [Luo, Siwei]Beijing Univ Technol, Coll Mat Sci & Engn, Key Lab Adv Funct Mat, Educ Minist China, Beijing 100124, Peoples R China
  • [ 4 ] [Ming, Bangming]Beijing Univ Technol, Coll Mat Sci & Engn, Key Lab Adv Funct Mat, Educ Minist China, Beijing 100124, Peoples R China
  • [ 5 ] [Wang, Bingrong]Beijing Univ Technol, Coll Mat Sci & Engn, Key Lab Adv Funct Mat, Educ Minist China, Beijing 100124, Peoples R China
  • [ 6 ] [Wang, Ruzhi]Beijing Univ Technol, Coll Mat Sci & Engn, Key Lab Adv Funct Mat, Educ Minist China, Beijing 100124, Peoples R China

通讯作者信息:

  • 王如志

    [Wang, Changhao]Beijing Univ Technol, Coll Mat Sci & Engn, Key Lab Adv Funct Mat, Educ Minist China, Beijing 100124, Peoples R China;;[Wang, Ruzhi]Beijing Univ Technol, Coll Mat Sci & Engn, Key Lab Adv Funct Mat, Educ Minist China, Beijing 100124, Peoples R China

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来源 :

PHYSICS LETTERS A

ISSN: 0375-9601

年份: 2020

期: 28

卷: 384

2 . 6 0 0

JCR@2022

ESI学科: PHYSICS;

ESI高被引阀值:26

JCR分区:2

被引次数:

WoS核心集被引频次: 7

SCOPUS被引频次: 5

ESI高被引论文在榜: 0 展开所有

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