Assigning Single-Crystal NMR Data to Crystallographic Sites for Symmetry-Affected Interaction Tensors: A Case Study of Sinhalite, MgAlBO 4 , by 11 B and 27 Al NMR Spectroscopy and DFT Calculations.

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Title: Assigning Single-Crystal NMR Data to Crystallographic Sites for Symmetry-Affected Interaction Tensors: A Case Study of Sinhalite, MgAlBO 4 , by 11 B and 27 Al NMR Spectroscopy and DFT Calculations.
Authors: Steinadler, Jennifer1, Witthaut, Kristian1,2, Krach, Georg1, Hochleitner, Rupert2, Bräuniger, Thomas1, thomas.braeuniger@cup.lmu.de
Source: Crystals (2073-4352); Jun2026, Vol. 16 Issue 6, p395, 23p
Database: Applied Science & Technology Source
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ISSN:20734352
DOI:10.3390/cryst16060395