Issue 9, 2000
From the journal:

Chemical Communications

An assignment of the 23Na MAS NMR spectrum of Na5P3O10·6H2O using a general ab initio method

Clive Johnson,a   Elaine A. Moorea  and  Michael Mortimer*a  

* Corresponding authors

a Department of Chemistry, The Open University, Milton Keynes, UK
E-mail: m.mortimer@open.ac.uk

Abstract

A new assignment method based on the periodic ab initio calculation of 23Na quadrupole coupling information using the CRYSTAL95 code is described and applied to the multi-site problem posed by Na5P3O10·6H2O.

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Article information

DOI
https://doi.org/10.1039/B001724H
Article type
Communication
Submitted
02 Mar 2000
Accepted
30 Mar 2000
First published
18 Apr 2000

Chem. Commun., 2000, 791-792

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An assignment of the 23Na MAS NMR spectrum of Na5P3O10·6H2O using a general ab initio method

C. Johnson, E. A. Moore and M. Mortimer, Chem. Commun., 2000, 791 DOI: 10.1039/B001724H

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