Please use this identifier to cite or link to this item: http://scholarbank.nus.edu.sg/handle/10635/86986
Title: Structural requirements for fast lithium ion migration in Li 10GeP 2S 12
Authors: Adams, S. 
Prasada Rao, R. 
Issue Date: 28-Apr-2012
Source: Adams, S., Prasada Rao, R. (2012-04-28). Structural requirements for fast lithium ion migration in Li 10GeP 2S 12. Journal of Materials Chemistry 22 (16) : 7687-7691. ScholarBank@NUS Repository.
Abstract: Dynamic lithium distribution, structural stability and ion transport mechanism in the new ultrafast ion conductor Li 10GeP 2S 12 are clarified with the help of atomistic molecular dynamics simulations, revealing only a weak anisotropy of Li + diffusion, and a coupling of Li + cation diffusion to PS 4 3- anion rotational mobility. The role of a previously overlooked Li site and the limited structural stability at elevated temperatures are discussed for the first time. © 2012 The Royal Society of Chemistry.
Source Title: Journal of Materials Chemistry
URI: http://scholarbank.nus.edu.sg/handle/10635/86986
ISSN: 09599428
Appears in Collections:Staff Publications

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