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First-principles calculations to investigate structural, elastic and thermodynamic properties of new M2ScSnC2 (M=V or Nb) quaternary compounds for 312 MAX phases

In this research, the approach of FP-LAPW (full potential linearized augmented plane wave) is employed within WIEN2K for the investigations of structural, thermodynamic, electronic, and mechanical properties of the V2ScSnC2 and Nb2ScSnC2 MAX-phases quaternary compounds. The V2ScSnC2 and Nb2ScSnC2 co...

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Detalhes bibliográficos
Principais autores: Mohammed Bendjemai, Ahmed Azzouz Rached, Mudasser Husain, Ali Bentouaf, Nasir Rahman, Vineet Tirth, Ali Algahtani, Abdulaziz H. Alghtani, Tawfiq Al-Mughanam
Formato: Artigo
Idioma:Inglês
Publicado em: Elsevier 2023-05-01
coleção:Journal of Materials Research and Technology
Assuntos:
Acesso em linha:http://www.sciencedirect.com/science/article/pii/S2238785423006750
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