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Stability of a new cubic monoxide of Thorium under pressure

Density functional theory has been applied to elucidate the stability of thorium monoxide (ThO). It is found out that the pressure can stabilize the rocksalt phase of ThO, and the transition pressure is estimated between 14 and 22 GPa. The stability of ThO can be attributed due to the gradually fill...

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Publicado en:Sci Rep
Autores principales: Sun, Weiwei, Luo, Wei, Ahuja, Rajeev
Formato: Artigo
Lenguaje:Inglês
Publicado: Nature Publishing Group 2015
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Acceso en línea:https://ncbi.nlm.nih.gov/pmc/articles/PMC4559911/
https://ncbi.nlm.nih.gov/pubmed/26337015
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep13740
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