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First-Principle Study of the Intercalation Process in the Li x V 2 O 5 System

✍ Scribed by Rocquefelte, Xavier; Boucher, Florent; Gressier, Pascal; Ouvrard, Guy

Book ID
126782936
Publisher
American Chemical Society
Year
2003
Tongue
English
Weight
197 KB
Volume
15
Category
Article
ISSN
0897-4756

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First-Principle Study of the Intercalati
First-Principle Study of the Intercalation Process in the Li x V 2 O 5 System
✍ Rocquefelte, Xavier; Boucher, Florent; Gressier, Pascal; Ouvrard, Guy πŸ“‚ Article πŸ“… 2003 πŸ› American Chemical Society 🌐 English βš– 197 KB

A theoretical study of the lithium intercalated Li x V 2 O 5 system has been performed using a dual approach, based on ab initio calculations and experimental data. Two main aspects have been investigated: the atomic structure of each phase and the voltage of a lithium battery with a positive electr