scholarly journals Mo2B, an MBene member with high electrical and thermal conductivities, and satisfactory performances in lithium ion batteries

2020 ◽  
Vol 2 (1) ◽  
pp. 347-355
Author(s):  
Xian-Hu Zha ◽  
Pengxiang Xu ◽  
Qing Huang ◽  
Shiyu Du ◽  
Rui-Qin Zhang

Mo2B, a predicted MBene, shows high thermal and electrical conductivities, and a relatively low migration energy barrier for Li ions.

Author(s):  
Kuan-Ching Wu ◽  
Chieh-Ming Hsieh ◽  
Bor Kae Chang

The olivine phosphate LiCoPO4 is a prospective cathode material in high voltage lithium ion batteries. During lithium diffusion, the ions must overcome diffusion energy barrier near the surface and in...


2017 ◽  
Vol 19 (9) ◽  
pp. 6861-6870 ◽  
Author(s):  
Youmin Sun ◽  
Yixuan Wang

The electroreduction of ES, an additive of the electrolyte of lithium-ion batteries was theoretically reinvestigated. The newly located concerted pathway has lower energy barrier than the stepwise pathway in literature.


2020 ◽  
Vol 22 (10) ◽  
pp. 5807-5818 ◽  
Author(s):  
Shirchinnamjil Nyamdelger ◽  
Tumentsereg Ochirkhuyag ◽  
Deleg Sangaa ◽  
Dorj Odkhuu

MXene V2C structure provides a specific theoretical capacity as high as 472 mA h g−1 at the Li2V2C stoichiometry and extremely fast diffusion with an energy barrier less than 0.1 eV. These intriguing findings are robust against intrinsic structural defects.


2019 ◽  
Vol 7 (20) ◽  
pp. 12706-12712 ◽  
Author(s):  
Saibal Jana ◽  
Siby Thomas ◽  
Chi Ho Lee ◽  
Byeongsun Jun ◽  
Sang Uck Lee

A high performance B3S monolayer for LIB anode material with high storage capacity, low OCV and low Li diffusion energy barrier.


2021 ◽  
Author(s):  
Zhifang Yang ◽  
Wenliang li ◽  
Jingping Zhang

Abstract It is urgent to explore high-capacity and efficient anode materials for rechargeable lithium-ion batteries (LIB). For borophene and phosphorene, two configurations are considered to form a heterojunction: twist angles of 0º (I) and 90º (II). There is a less degree of mismatch and larger formation energy in the formation of a B/P heterojunction, implying that borophene and phosphorene form the stable heterojunction. The heterojunctions of these two configurations demonstrate good conductivity, and the electrons near the Fermi level are mainly provided by borophene. Very importantly, the low energy barrier for interlayer migration of Li is observed in configuration I (0.14eV) and II (0.06 eV), and the migration of Li on the borophene and phosphorene side of the heterojunction still maintains its original energy barrier in bare monolayer. Moreover, the two configurations show the theoretical capacity as high as 738.69 and 721.86 mA h g-1, respectively, which is comparable to bare phosphorene. Furthermore, compared with bare phosphorene, the average voltage is greatly reduced after the formation of heterojunction. Hence, the overall electrochemical properties of the B/P heterojunction have been enhanced by combining the advantages of the individual phosphorene and borophene monolayers, which guarantees the B/P heterojunction as a good candidate for the anode material used in Li-ion batteries.


Author(s):  
Shaohua Lu ◽  
Weidong Hu ◽  
Xiaojun Hu

Due to their low cost and improved safety compared to lithium-ion batteries, sodium-ion batteries have attracted worldwide attention in recent decades.


Author(s):  
А.Б. Абдрахманова ◽  
◽  
В. А. Кривченко ◽  
Н. М. Омарова

2017 ◽  
Vol 137 (8) ◽  
pp. 481-486
Author(s):  
Junichi Hayasaka ◽  
Kiwamu Shirakawa ◽  
Nobukiyo Kobayashi ◽  
Kenichi Arai ◽  
Nobuaki Otake ◽  
...  

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