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Structural investigation of α-LaZr2F11 by coupling X-ray powder diffraction, 19F solid state NMR and DFT calculations

✍ Scribed by Martineau, Charlotte; Legein, Christophe; Body, Monique; Péron, Olivier; Boulard, Brigitte; Fayon, Franck


Book ID
120388738
Publisher
Elsevier Science
Year
2013
Tongue
English
Weight
797 KB
Volume
199
Category
Article
ISSN
0022-4596

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## Abstract The molecular configuration and crystal structure of solid polycrystalline __N__,__N__′′‐diacetylbiuret (DAB), a potential nitrogen‐rich fertilizer, have been analyzed by a combination of solid‐ and liquid‐state NMR spectroscopy, X‐ray diffraction, and DFT calculations. Initially a pure