Ab initio simulation of proton spin diffusion
2010
Abstract
The many-body nature of the ubiquitous spin diffusion phenomenon makes it difficult to predict accurately from first principles. We show how the use of reduced Liouville spaces makes it possible to reproduce experimental proton spin diffusion measurements directly from crystalline geometry for powdered solids under magic-angle spinning.
Details
Title
Ab initio simulation of proton spin diffusion
Author(s)
Dumez, Jean-Nicolas ; Butler, Mark C. ; Salager, Elodie ; Elena-Herrmann, Benedicte ; Emsley, Lyndon
Published in
Physical Chemistry Chemical Physics
Volume
12
Issue
32
Pages
9172-9175
Date
2010
Publisher
ROYAL SOC CHEMISTRY
ISSN
1463-9076
Other identifier(s)
View record in Web of Science
Laboratories
LRM
Record Appears in
Scientific production and competences > SB - School of Basic Sciences > ISIC - Institute of Chemical Sciences and Engineering > LRM - Laboratory of Magnetic Resonance
Peer-reviewed publications
Work outside EPFL
Journal Articles
Published
Peer-reviewed publications
Work outside EPFL
Journal Articles
Published
Record creation date
2015-01-08