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Exploring Accuracy Limits of Predictions of the (1)H NMR Chemical Shielding Anisotropy in the Solid State

The (1)H chemical shielding anisotropy (CSA) is an NMR parameter that is exquisitely sensitive to the local environment of protons in crystalline systems, but it is difficult to obtain it experimentally due to the need to concomitantly suppress other anisotropic interactions in the solid-state NMR (...

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Detalles Bibliográficos
Autores principales: Czernek, Jiří, Brus, Jiří
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6539467/
https://www.ncbi.nlm.nih.gov/pubmed/31058873
http://dx.doi.org/10.3390/molecules24091731