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Abstract
Molecular modeling using polarizable force fields of W-doped lithium containing garnets to understand the various aspect of the impact of doping on the lithium dynamics and conductivity.
Doping in Garnet-Type Electrolytes: Kinetic and Thermodynamic Effects from Molecular Dynamics Simulations
25 January 2019, Version 1
Working Paper
This content is a preprint and has not undergone peer review at the time of posting.
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Version History
Jan 25, 2019 Version 1
Version Notes
Revision 1
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Funding
Swiss National Science Foundation
141828
NCCR MARVEL: Materials’ Revolution: Computational Design and Discovery of Novel Materials (phase I)
Author’s competing interest statement
No conflict of interest