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Periodic Density Functional Theory Calculations of Uranyl Tetrachloride Compounds Engaged in Uranyl–Cation and Uranyl–Hydrogen Interactions: Electronic Structure, Vibrational, and Thermodynamic Analyses
[Image: see text] Solid-state uranyl hybrid structures are often formed through unique intermolecular interactions occurring between a molecular uranyl anion and a charge-balancing cation. In this work, solid-state structures of the uranyl tetrachloride anion engaged in uranyl–cation and uranyl–hydr...
Autores principales: | Augustine, Logan J., Rajapaksha, Harindu, Pyrch, Mikaela Mary F., Kasperski, Maguire, Forbes, Tori Z., Mason, Sara E. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2022
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9832540/ https://www.ncbi.nlm.nih.gov/pubmed/36538814 http://dx.doi.org/10.1021/acs.inorgchem.2c03476 |
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