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Electron, phonon and thermoelectric properties of Cu(7)PS(6) crystal calculated at DFT level

The promising class of the environment-friendly thermoelectrics is the copper-based argyrodite-type ion-conducting crystals exhibiting just extraordinary low thermal conductivity below the glass limit associated with the molten copper sublattice leading to a softening of phonon modes. To explain why...

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Detalles Bibliográficos
Autores principales: Andriyevsky, B., Barchiy, I. E., Studenyak, I. P., Kashuba, A. I., Piasecki, M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8463705/
https://www.ncbi.nlm.nih.gov/pubmed/34561499
http://dx.doi.org/10.1038/s41598-021-98515-6