SIMULATION OF NMR POWDER SPECTRA

被引：50

作者：

AMOUREUX, JP

FERNANDEZ, C

CARPENTIER, L

COCHON, E

机构：

[1] Laboratoire de Dynamique Et Structure Des Matériaux Moléculaires, C.N.R.S U.A. 801, Universite Des Sciences Et Technologies de Lille, Villeneuve D'ascq

来源：

PHYSICA STATUS SOLIDI A-APPLIED RESEARCH | 1992年 / 132卷 / 02期

关键词：

D O I：

10.1002/pssa.2211320222

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

The basic principles and the main functions of a computer program are described which simulates solid-state NMR powder spectra when quadrupolar interaction and/or chemical shift anisotropy dominate the line broadening. Several application examples are given for various nuclei in solid materials. The main advantage of the approach used in this simulation program is the rapidity of computation even when several sidebands have to be calculated for spectra of spinning samples. Another important feature of the program is the possibility of taking into account the main experimental conditions used to record a spectrum on a pulsed Fourier transform spectrometer.

引用

页码：461 / 475

页数：15

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