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Joint Experimental and Computational (17)O and (1)H Solid State NMR Study of Ba(2)In(2)O(4)(OH)(2) Structure and Dynamics
[Image: see text] A structural characterization of the hydrated form of the brownmillerite-type phase Ba(2)In(2)O(5), Ba(2)In(2)O(4)(OH)(2), is reported using experimental multinuclear NMR spectroscopy and density functional theory (DFT) energy and GIPAW NMR calculations. When the oxygen ions from H...
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| Publicado no: | Chem Mater |
|---|---|
| Main Authors: | , , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American Chemical
Society
2015
|
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4547502/ https://ncbi.nlm.nih.gov/pubmed/26321789 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.chemmater.5b00328 |
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