Modelling one- and two-dimensional solid-state NMR spectra
✍ Scribed by Dominique Massiot; Franck Fayon; Mickael Capron; Ian King; Stéphanie Le Calvé; Bruno Alonso; Jean-Olivier Durand; Bruno Bujoli; Zhehong Gan; Gina Hoatson
- Publisher
- John Wiley and Sons
- Year
- 2001
- Tongue
- English
- Weight
- 420 KB
- Volume
- 40
- Category
- Article
- ISSN
- 0749-1581
- DOI
- 10.1002/mrc.984
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## Abstract Two Java applets, which allow viewing and simple reprocessing operations of one‐ and two‐dimensional NMR spectra from within a web page, are described. For the 1D viewer, phasing, integration, peak picking and referencing are supported. Bruker, Varian and JCAMP‐DX processed data files c
switched-angle sample spinning (SASS) (13); however, this By comparing experimental and calculated two-dimenis limited to situations where the isotropic spectra have only sional anisotropic chemical-shift/heteronuclear dipolar coua few resonances and is technically demanding because of pling [separa
A method for the inclusion of the effects of z-axis pulsed field gradients in computer simulations of an arbitrary pulsed NMR experiment with spin 1 2 nuclei is described. Recognizing that the phase acquired by a coherence following the application of a z-axis pulsed field gradient bears a fixed rel