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Static and Dynamical Properties of heavy actinide Monopnictides of Lutetium

In this work, density functional theory within the framework of generalized gradient approximation has been used to investigate the structural, elastic, mechanical, and phonon properties of lutetium monopnictides in rock-salt crystal structure. The spin orbit coupling and Hubbard-U corrections are i...

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Detalhes bibliográficos
Publicado no:Sci Rep
Main Authors: Mir, Showkat H., Jha, Prakash C., Islam, M. S., Banarjee, Amitava, Luo, Wei, Dabhi, Shweta D., Jha, Prafulla K., Ahuja, R.
Formato: Artigo
Idioma:Inglês
Publicado em: Nature Publishing Group 2016
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4935863/
https://ncbi.nlm.nih.gov/pubmed/27384709
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep29309
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