Modelling one- and two-dimensional solid-state NMR spectra

Authors

  • Dominique Massiot,

    Corresponding author
    1. Centre de Recherche sur les Matériaux à Haute Température, CRMHT-CNRS, 1D avenue de la Recherche Scientifique, 45071 Orléans cedex 2, France
    • Centre de Recherche sur les Matériaux à Haute Température, CRMHT-CNRS, 1D avenue de la Recherche Scientifique, 45071 Orléans cedex 2, France
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  • Franck Fayon,

    1. Centre de Recherche sur les Matériaux à Haute Température, CRMHT-CNRS, 1D avenue de la Recherche Scientifique, 45071 Orléans cedex 2, France
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  • Mickael Capron,

    1. Centre de Recherche sur les Matériaux à Haute Température, CRMHT-CNRS, 1D avenue de la Recherche Scientifique, 45071 Orléans cedex 2, France
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  • Ian King,

    1. Centre de Recherche sur les Matériaux à Haute Température, CRMHT-CNRS, 1D avenue de la Recherche Scientifique, 45071 Orléans cedex 2, France
    2. Department of Chemistry, University of Durham, Durham, UK
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  • Stéphanie Le Calvé,

    1. Centre de Recherche sur les Matériaux à Haute Température, CRMHT-CNRS, 1D avenue de la Recherche Scientifique, 45071 Orléans cedex 2, France
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  • Bruno Alonso,

    1. Centre de Recherche sur les Matériaux à Haute Température, CRMHT-CNRS, 1D avenue de la Recherche Scientifique, 45071 Orléans cedex 2, France
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  • Jean-Olivier Durand,

    1. Laboratoire de Chimie Moléculaire et Organisation du Solide, UMR 5637, Case 007, Université Montpellier 2, Place Eugène Bataillon, 34095 Montpellier cedex 05, France
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  • Bruno Bujoli,

    1. Laboratoire de Synthèse Organique, UMR CNRS 6513, 2 Rue de la Houssinière, BP 92208, 44322 Nantes cedex 03, France
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  • Zhehong Gan,

    1. Center of Interdisciplinary Magnetic Resonance, NHMFL, Tallahassee, Florida 32310, USA
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  • Gina Hoatson

    1. College of William & Mary, Department of Physics, Box 8795, Williamsburg, Virginia 23187-8795, USA
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  • Dedicated to Professor Robin K. Harris on the occasion of his 65th birthday

Abstract

With the description of more and more complex one- and two-dimensional NMR experiments comes the need to develop methods to make a comprehensive interpretation of the various different experiments that can be carried out on the same sample or series of related samples. We present some examples of modelling one- and two-dimensional solid-state NMR spectra of I = ½ spin and quadrupolar nuclei, using laboratory-developed software that is made available to the NMR community. Copyright © 2001 John Wiley & Sons, Ltd.

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