2D Si3N as a Promising Anode Material for Li/Na-Ion Batteries from First-Principles Study

2020 ◽  
Vol 49 (7) ◽  
pp. 4180-4185 ◽  
Author(s):  
Hui Li ◽  
Jianhua Hou ◽  
Dayong Jiang
Keyword(s):  
Anode Material ◽  
First Principles ◽  
First Principles Study

First principles study of a SnS2/graphene heterostructure: a promising anode material for rechargeable Na ion batteries

2016 ◽  
Vol 4 (37) ◽  
pp. 14316-14323 ◽  
Author(s):  
Abdus Samad ◽  
Mohammad Noor-A-Alam ◽  
Young-Han Shin
Keyword(s):  
Ionic Conductivity ◽  
Anode Material ◽  
First Principles ◽  
Storage Capacity ◽  
Mechanical Stability ◽  
Low Cost ◽  
High Potential ◽  
First Principles Study

The low cost, high Na storage capacity, high electronic and ionic conductivity, nontoxic nature, and enhanced mechanical stability of the SnS2/graphene heterostructure show the high potential of this material as a commercial anode material for Na ion batteries.

Li intercalation mechanisms in CaTi5O11, a bronze-B derived compound

2016 ◽  
Vol 18 (47) ◽  
pp. 32042-32049 ◽  
Author(s):  
Donghee Chang ◽  
Anton Van der Ven
Keyword(s):  
Electrochemical Properties ◽  
Anode Material ◽  
First Principles ◽  
Li Ion Batteries ◽  
First Principles Study ◽  
Li Ion

A first-principles study was performed to elucidate the electrochemical properties of CaTi5O11, a recently discovered compound that is a crystallographic variant of TiO2(B) and that shows promise as an anode material for Li-ion batteries.

First-principles study of a substitutionally doped phosphorene as anode material for Na-ion batteries

2020 ◽  
Vol 532 ◽  
pp. 147377 ◽  
Author(s):  
Artur P. Durajski ◽  
Konrad M. Gruszka ◽  
Paweł Niegodajew
Keyword(s):  
Anode Material ◽  
First Principles ◽  
First Principles Study

First-principles study of monolayer Be2C as an anode material for lithium-ion batteries

2019 ◽  
Vol 126 (12) ◽  
pp. 125302 ◽  
Author(s):  
K. H. Yeoh ◽  
K.-H. Chew ◽  
Y. Z. Chu ◽  
T. L. Yoon ◽  
Rusi ◽  
...  
Keyword(s):  
Lithium Ion Batteries ◽  
Anode Material ◽  
First Principles ◽  
Lithium Ion ◽  
First Principles Study
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