Modelling J-coupling in NMR Spectra at Low and Ultra-low Magnetic Fields

Modeling of low-field NMR spectra with indirect spin-spin interaction (J-coupling) is not included in popular NMR software. Modeling NMR spectra for cases of various magnetic fields is necessary not only for the interpretation of spectra, but also for the planning of experiments. The developed versi...

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Main Authors: Gimatdin, Rifat, Kupriyanov, Pavel, Mozzhukhin, Georgy, Chizhik, Vladimir, Rameev, Bulat
Format: Conference Proceeding
Language:English
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Electromagnetics
Magnetic fields
Nuclear magnetic resonance
Planning
Protons
Software
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creator Gimatdin, Rifat
Kupriyanov, Pavel
Mozzhukhin, Georgy
Chizhik, Vladimir
Rameev, Bulat
description Modeling of low-field NMR spectra with indirect spin-spin interaction (J-coupling) is not included in popular NMR software. Modeling NMR spectra for cases of various magnetic fields is necessary not only for the interpretation of spectra, but also for the planning of experiments. The developed versions of the program make it possible to obtain model NMR spectra with J-coupling at any values of the magnetic field. As examples, the real proton NMR spectra of triethyl phosphate at different magnetic fields are considered in comparison with model ones. The peculiarities of NMR spectra at certain values of magnetic field are discussed.
doi_str_mv 10.1109/PIERS62282.2024.10618049
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subjects Electromagnetics
Magnetic fields
Nuclear magnetic resonance
Planning
Protons
Software
title Modelling J-coupling in NMR Spectra at Low and Ultra-low Magnetic Fields
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