http://www.cnr.it/ontology/cnr/individuo/prodotto/ID232498
Simulation of One-Dimensional Magnetic Resonance Powder Line Shapes Reduced to Area Computation (Articolo in rivista)
- Type
- Label
- Simulation of One-Dimensional Magnetic Resonance Powder Line Shapes Reduced to Area Computation (Articolo in rivista) (literal)
- Anno
- 1999-01-01T00:00:00+01:00 (literal)
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#doi
- 10.1016/S0009-2614(99)00117-7 (literal)
- Alternative label
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori
- Pagina inizio
- Pagina fine
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroVolume
- Rivista
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#affiliazioni
- Consiglio Nazionale delle Ricerche, Centro per lo Studio sulle Relazioni tra Struttura e Reattivita` Chimica, Via C. Golgi 19, I-20133 Milan, Italy (literal)
- Titolo
- Simulation of One-Dimensional Magnetic Resonance Powder Line Shapes Reduced to Area Computation (literal)
- Abstract
- Up to now, computation of magnetic resonance powder lineshapes has been performed by summing single-crystal spectra
computed at different orientations. In this Letter, a novel method to compute one-dimensional magnetic resonance powder
spectra from experiments with axially symmetric setup is proposed. It is based on an adaptive interpolation technique
requiring the calculation of contours of constant transition frequency and constant line amplitude. and of the area of the
regions enclosed by such contours. The method is given mathematical justification, is implemented in a computer program,
and its efficiency is compared with that of existing methods. Extension to multi-dimensional spectra and to experiments with
non-axial setup is briefly discussed. (literal)
- Prodotto di
- Autore CNR
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