EasySpin, a comprehensive software package for spectral simulation and analysis in EPR

EasySpin, a computational package for spectral simulation and analysis in EPR, is described. It is based on Matlab, a commercial technical computation software. EasySpin provides extensive EPR-related functionality, ranging from elementary spin physics to data analysis. In addition, it provides rout...

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Bibliographic Details
Published inJournal of magnetic resonance (1997) Vol. 178; no. 1; pp. 42 - 55
Main Authors Stoll, Stefan, Schweiger, Arthur
Format Journal Article
LanguageEnglish
Published United States Elsevier Inc 2006
Subjects
Breit–Rabi
ENDOR
EPR
EPR
ENDOR
Breit–Rabi
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Summary:EasySpin, a computational package for spectral simulation and analysis in EPR, is described. It is based on Matlab, a commercial technical computation software. EasySpin provides extensive EPR-related functionality, ranging from elementary spin physics to data analysis. In addition, it provides routines for the simulation of liquid- and solid-state EPR and ENDOR spectra. These simulation functions are built on a series of novel algorithms that enhance scope, speed and accuracy of spectral simulations. Spin systems with an arbitrary number of electron and nuclear spins are supported. The structure of the toolbox as well as the theoretical background underlying its simulation functionality are presented, and some illustrative examples are given.
Bibliography:ObjectType-Article-1
SourceType-Scholarly Journals-1
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ISSN:1090-7807
1096-0856
DOI:10.1016/j.jmr.2005.08.013