High-Throughput Screening of Solid-State Li-Ion Conductors Using Lattice-Dynamics Descriptors

Low lithium-ion migration barriers have recently been associated with low average vibrational frequencies or phonon band centers, further helping identify descriptors for superionic conduction. To further explore this correlation, here we present the computational screening of ∼14,000 Li-containing...

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Detalles Bibliográficos
Autores principales: Muy, Sokseiha, Voss, Johannes, Schlem, Roman, Koerver, Raimund, Sedlmaier, Stefan J., Maglia, Filippo, Lamp, Peter, Zeier, Wolfgang G., Shao-Horn, Yang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2019
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6581664/
https://www.ncbi.nlm.nih.gov/pubmed/31203184
http://dx.doi.org/10.1016/j.isci.2019.05.036

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6581664/
https://www.ncbi.nlm.nih.gov/pubmed/31203184
http://dx.doi.org/10.1016/j.isci.2019.05.036

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