Superionic Conduction in Substoichiometric LiAl Alloy: An Ab Initio Study

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Superionic Conduction in Substoichiometric LiAl Alloy: An Ab Initio Study

Based on the new ab initio molecular dynamics method by Kuhne et al. [Phys. Rev. Lett. 98, 066401 (2007)], we studied the mechanism of superionic conduction in substoichiometric Li-poor Li1xAl alloys by performing simulations at different temperatures for an overall simulation time of about 1 ns. Th...

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Bibliographic Details
Main Authors:	Cucinotta, C., Miceli, G., Raiteri, Paolo, Krack, M., Kuhne, T., Bernasconi, M., Parinello, M.
Format:	Journal Article
Published:	The American Physical Society 2009
Online Access:	http://hdl.handle.net/20.500.11937/28706

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