Crystallographic structure refinement with quadrupolar nuclei: a combined solid-state NMR and GIPAW DFT example using MgBr2†
Abstract
- This article is part of the themed collection: Highlighting Canadian research in PCCP
* Corresponding authors
a
Department of Chemistry and Centre for Catalysis Research and Innovation, University of Ottawa, 10 Marie Curie Pvt, Ottawa, Ontario, Canada
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dbryce@uottawa.ca
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Tel: +1 (1)613 562 5800 ext. 2018
C. M. Widdifield and D. L. Bryce, Phys. Chem. Chem. Phys., 2009, 11, 7120 DOI: 10.1039/B911448N
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