✦ LIBER ✦
Solid state NMR sideband shape simulations for any spinning angle and speed. First order calculation of residual dipolar coupling to quadrupolar nuclei
✍ Scribed by Alejandro C. Olivieri
- Publisher
- Elsevier Science
- Year
- 1997
- Tongue
- English
- Weight
- 531 KB
- Volume
- 10
- Category
- Article
- ISSN
- 0926-2040
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✦ Synopsis
A simple procedure is described which can be used to simulate solid state NMR sideband shapes for samples rotating at any angle and speed, when a combination of chemical shift anisotropy and dipolar coupling between spin-l/2 and quadrupolar nuclei occurs. The use of Herzfeld-Berger equations for computing individual sideband intensities is coupled to first order perturbation calculation of dipolar coupling effects. The present method can be easily and efficiently implemented on a desktop computer (source code is provided). 0 1997 Elsevier Science B.V.