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Rives, S., Jobic, H., Ollivier, J., Yang, K., Devic, T., Serre, C. & Maurin, G. (2013) Diffusion of Branched and Linear C-6-Alkanes in the MIL-47(V) Metal-Organic Framework.. JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN, 82.
Added by: Richard Baschera (2017-03-01 08:48:22) |
| Type de référence: Article DOI: {10.7566/JPSJS.82SA.SA005} Numéro d'identification (ISBN etc.): {0031-9015} Clé BibTeX: Rives{2013}a Voir tous les détails bibliographiques  |
Catégories: HORSIMN Créateurs: Devic, Jobic, Maurin, Ollivier, Rives, Serre, Yang Collection: {JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN} |
Consultations : 1/411
Indice de consultation : 3% Indice de popularité : 0.75% |
| Résumé |
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{The self-diffusion of hexane isomers in MIL-47(V) has been investigated by combining quasi-elastic neutron scattering (QENS) and molecular dynamics (MD) simulations. Experimentally, the diffusivity of n-hexane is found to be larger than the one of 3-methylpentane. MD simulations bring further insight into the microscopic diffusion mechanism in play confirming that diffusion proceeds via a jump sequence, as observed by QENS.}
Added by: Richard Baschera |