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Theoretical Insights on the High Pressure Behavior of Pentazolate Anion Complex [Co(H(2)O)(4)(N(5))(2)]·4H(2)O

Periodic dispersion corrected density functional theory (DFT) calculations were carried out to examine the Hirshfeld surface, two dimensional (2D) fingerprint plots, crystal structure, molecular structure and density of state of all-nitrogen pentazolate anion complex [Co(H(2)O)(4)(N(5))(2)]·4H(2)O u...

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Detalles Bibliográficos
Autores principales:	Zhao, Guozheng, Li, Huili, Jia, Jianfeng, Wu, Haishun, Lu, Ming
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Nature Publishing Group UK 2019
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6821737/ https://www.ncbi.nlm.nih.gov/pubmed/31666628 http://dx.doi.org/10.1038/s41598-019-52232-3

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