Solid-state electrolytes: Revealing the mechanisms of Li-Ion conduction in tetragonal and cubic LLZO by first-principles calculations

Journal of Physical Chemistry C

Volumn 118, Issue 13, 2014, Pages 6668-6679

  Meier, Katharina ^a   Laino, Teodoro ^a   Curioni, Alessandro ^a  

^a IBM RESEARCH ZURICH   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

AB-INITIO MOLECULAR DYNAMICS; COLLECTIVE MOTIONS; DIFFERENT MECHANISMS; ENERGETIC BARRIERS; EXPERIMENTAL VALUES; FIRST-PRINCIPLES CALCULATION; SOLID-STATE ELECTROLYTE; STRUCTURAL FEATURE;

ELECTROLYTES; LITHIUM; MOLECULAR DYNAMICS;

CALCULATIONS;

EID: 84898069386     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp5002463     Document Type: Article

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