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Computer simulation of magnetic resonance spectra employing homotopy.

作者信息

Gates K E, Griffin M, Hanson G R, Burrage K

机构信息

Department of Mathematics, The University of Queensland, St. Lucia, Queensland, 4072, Australia.

出版信息

J Magn Reson. 1998 Nov;135(1):104-12. doi: 10.1006/jmre.1998.1575.

DOI:10.1006/jmre.1998.1575
PMID:9799683
Abstract

Multidimensional homotopy provides an efficient method for accurately tracing energy levels and hence transitions in the presence of energy level anticrossings and looping transitions. Herein we describe the application and implementation of homotopy to the analysis of continuous wave electron paramagnetic resonance spectra. The method can also be applied to electron nuclear double resonance, electron spin echo envelope modulation, solid-state nuclear magnetic resonance, and nuclear quadrupole resonance spectra.

摘要

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