An Investigation on Substitution of Ag Atoms for Al or Ti Atoms in the Ti(2)AlC MAX Phase Ceramic Based on First-Principles Calculations

The present work introduced first-principles calculation to explore the substitution behavior of Ag atoms for Al or Ti atoms in the Ti(2)AlC MAX phase ceramic. The effect of Ag substitution on supercell parameter, bonding characteristic, and stability of the Ti(2)AlC was investigated. The results sh...

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Detalles Bibliográficos
Autores principales: Wang, Guochao, Zhou, Jiahe, Chen, Weijian, Yang, Jianguo, Zhang, Jie, He, Yanming
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8618674/
https://www.ncbi.nlm.nih.gov/pubmed/34832467
http://dx.doi.org/10.3390/ma14227068

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8618674/
https://www.ncbi.nlm.nih.gov/pubmed/34832467
http://dx.doi.org/10.3390/ma14227068

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