Chapter 31. Alternative Fermi Contact Operators for EPR and NMR

  1. Prof. Dr. Martin Kaupp3,
  2. Dr. Michael Bühl Priv. Doz.4 and
  3. Dr. Vladimir G. Malkin DrSc.5
  1. Vitaly A. Rassolov1 and
  2. Daniel M. Chipman2

Published Online: 9 JUN 2004

DOI: 10.1002/3527601678.ch31

Calculation of NMR and EPR Parameters: Theory and Applications

Calculation of NMR and EPR Parameters: Theory and Applications

How to Cite

Rassolov, V. A. and Chipman, D. M. (2004) Alternative Fermi Contact Operators for EPR and NMR, in Calculation of NMR and EPR Parameters: Theory and Applications (eds M. Kaupp, M. Bühl and V. G. Malkin), Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim, FRG. doi: 10.1002/3527601678.ch31

Editor Information

  1. 3

    Institute of Inorganic Chemistry, University of Würzburg, Am Hubland, 97074 Würzburg, Germany

  2. 4

    Max-Planck-Institute for Coal Research, Kaiser-Wilhelm-Platz 1, 45470 Mülheim an der Ruhr, Germany

  3. 5

    Institute of Inorganic Chemistry, Slovak Academy of Sciences, Dubravska cesta 9, SK-84536 Bratislava, Slovak Republic

Author Information

  1. 1

    Department of Chemistry and Biochemistry, University of South Carolina, 691 Sumter Street, Columbia, SC 29208, USA

  2. 2

    Radiation Laboratory, University of Notre Dame, Notre Dame, IN 46556, USA

Publication History

  1. Published Online: 9 JUN 2004
  2. Published Print: 25 MAY 2004

ISBN Information

Print ISBN: 9783527307791

Online ISBN: 9783527601677

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Keywords:

  • Fermi contact operators;
  • new alternative operators;
  • EPR and NMR

Summary

This chapter contains sections titled:

  • Introduction

  • Derivation of New Alternative Operators

  • Formal Properties of Short-Range Alternative Operators

  • EPR Calculations

  • NMR Calculations

  • Conclusions