scholarly journals Ab initio study of radiation effects on the Li4Ti5O12 electrode used in lithium-ion batteries

AIP Advances ◽  
2015 ◽  
Vol 5 (4) ◽  
pp. 047110 ◽  
Author(s):  
Adib Samin ◽  
Michael Kurth ◽  
Lei Cao
Keyword(s):  
Ab Initio ◽  
Lithium Ion Batteries ◽  
Radiation Effects ◽  
Lithium Ion ◽  
Ab Initio Study

Ni-stabilizing additives for completion of Ni-rich layered cathode systems in lithium-ion batteries: An Ab initio study

2019 ◽  
Vol 418 ◽  
pp. 74-83 ◽  
Author(s):  
Dong Young Kim ◽  
Insun Park ◽  
Yongwoo Shin ◽  
Dong-Hwa Seo ◽  
Yoon-Sok Kang ◽  
...  
Keyword(s):  
Ab Initio ◽  
Lithium Ion Batteries ◽  
Lithium Ion ◽  
Ab Initio Study

Decomposition of the fluoroethylene carbonate additive and the glue effect of lithium fluoride products for the solid electrolyte interphase: an ab initio study

2016 ◽  
Vol 18 (12) ◽  
pp. 8643-8653 ◽  
Author(s):  
Yukihiro Okuno ◽  
Keisuke Ushirogata ◽  
Keitaro Sodeyama ◽  
Yoshitaka Tateyama
Keyword(s):  
Solid Electrolyte ◽  
Lithium Ion Batteries ◽  
Electrolyte Solution ◽  
Lithium Fluoride ◽  
Solid Electrolyte Interphase ◽  
Lithium Ion ◽  
Ab Initio Study ◽  
Fluoroethylene Carbonate ◽  
The Stability ◽  
Fluoroethylene Carbonate Additive

Additives in the electrolyte solution of lithium-ion batteries (LIBs) have a large impact on the performance of the solid electrolyte interphase (SEI) that forms on the anode and is a key to the stability and durability of LIBs.

Ab initio calculations of lithium titanates related to anodes of lithium-ion batteries

2020 ◽  
Vol 141 ◽  
pp. 109405 ◽  
Author(s):  
Sebastián Amaya-Roncancio ◽  
Luis Reinaudi ◽  
Susana Chauque ◽  
Fabiana Y. Oliva ◽  
Osvaldo R. Cámara ◽  
...  
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Lithium Ion Batteries ◽  
Lithium Ion

Ab initio identification of the Li-rich phase in LiFePO4

2018 ◽  
Vol 20 (25) ◽  
pp. 17497-17503 ◽  
Author(s):  
Hua Zeng ◽  
Yue Gu ◽  
Gaofeng Teng ◽  
Yimeng Liu ◽  
Jiaxin Zheng ◽  
...  
Keyword(s):  
Ab Initio ◽  
Lithium Ion Batteries ◽  
Cathode Materials ◽  
Theoretical Study ◽  
Lithium Ion ◽  
Rich Phase

This article provides a systematic theoretical study of Li-rich phase Li1+xFe1−xPO4 (x ≤ 12.5%) cathode materials for lithium-ion batteries.

Investigation of Li3P as Electrolyte and Lithium-ion conductor: An Ab- Initio Study

2021 ◽  
Author(s):  
Keyvan Khosh Abady ◽  
Amin Niksirat ◽  
Negar Karpourazar ◽  
Mahdi Pourfath
Keyword(s):  
Ab Initio ◽  
Lithium Ion ◽  
Ab Initio Study ◽  
Ion Conductor
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