Cargando…
Theoretical exploration of inherent electronic, structural, mechanical, thermoelectric, and thermophysical response of KRu(4)Z(12) (Z = As(12), Sb(12)) filled skutterudite materials
Using the density functional theory methodology, we have thoroughly examined KRu(4)As(12) and KRu(4)Sb(12) skutterudites, including their structural, electronic, mechanical, transport, and thermodynamic properties. First and foremost, using the Birch–Murnaghan equation of state, the structural stabi...
| Autores principales: | , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
The Royal Society of Chemistry
2023
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10508261/ https://www.ncbi.nlm.nih.gov/pubmed/37731830 http://dx.doi.org/10.1039/d3ra05546a |