Understanding the computational insights of spin-polarised density functional theory into the newly half-metallic f electron-based actinide perovskites SrMO(3) (M = Pa, Np, Cm, Bk)

Here, we investigated the structural, mechanical, electronic, magnetic, thermodynamic and thermoelectric properties of Strontium based simple perovskites SrMO(3) (M = Pa, Np, Cm, Bk) by using density functional theory. First and foremost, the ground state stability of these perovskites was initially...

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Detalles Bibliográficos
Autores principales: Gautam, Sakshi, Ghosh, Sukriti, Gupta, Dinesh C.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10558508/
https://www.ncbi.nlm.nih.gov/pubmed/37803067
http://dx.doi.org/10.1038/s41598-023-43624-7

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10558508/
https://www.ncbi.nlm.nih.gov/pubmed/37803067
http://dx.doi.org/10.1038/s41598-023-43624-7

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