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Exploring Hydrogen Incorporation into the Nb(4)AlC(3) MAX Phases: Ab Initio Calculations

The Nb(4)AlC(3) MAX phase can be regarded as a TMC structure with stacking faults, which has great potential as a novel solid hydrogen storage material. Herein, we used ab initio calculations for understanding the hydrogen incorporation into Nb(4)AlC(3) MAX phases, including equilibrium structural c...

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Detalles Bibliográficos
Autores principales:	Fu, Yudong, Li, Zifeng, Gao, Weihong, Zhao, Danni, Huang, Zhihao, Sun, Bin, Yan, Mufu, Liu, Guotan, Liu, Zihang
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2022
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9658730/ https://www.ncbi.nlm.nih.gov/pubmed/36363168 http://dx.doi.org/10.3390/ma15217576

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