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Crystal structure of anhydrous tripotassium citrate from laboratory X-ray powder diffraction data and DFT comparison
The crystal structure of anhydrous tripotassium citrate, [K(3)(C(6)H(5)O(7))](n), has been solved and refined using laboratory X-ray powder diffraction data, and optimized using density functional techniques. The three unique potassium cations are 6-, 8-, and 6-coordinate (all irregular). The [KO(n)...
Autores principales: | Rammohan, Alagappa, Kaduk, James A. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4971862/ https://www.ncbi.nlm.nih.gov/pubmed/27536403 http://dx.doi.org/10.1107/S2056989016011506 |
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