Electron, phonon and thermoelectric properties of Cu7PS6 crystal calculated at DFT level

Abstract 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 ex...

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Autores principales: B. Andriyevsky, I. E. Barchiy, I. P. Studenyak, A. I. Kashuba, M. Piasecki
Formato: article
Lenguaje:EN
Publicado: Nature Portfolio 2021
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Acceso en línea:https://doaj.org/article/c39490c748594befa1396ce424ce69c4
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