http://www.cnr.it/ontology/cnr/individuo/prodotto/ID57155
Lattice vibrations of para-hydrogen impurities in a solid deuterium matrix: An inelastic neutron scattering study (Articolo in rivista)
- Type
- Label
- Lattice vibrations of para-hydrogen impurities in a solid deuterium matrix: An inelastic neutron scattering study (Articolo in rivista) (literal)
- Anno
- 2007-01-01T00:00:00+01:00 (literal)
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#doi
- 10.1103/PhysRevB.76.174304 (literal)
- Alternative label
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori
- Colognesi D. (1); Celli M. (1); Ramirez-Cuesta A. J. (2); Zoppi M. (1) (literal)
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- Pagina fine
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- Rivista
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- Note
- ISI Web of Science (WOS) (literal)
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#affiliazioni
- 1) Consiglio Nazionale delle Ricerche, Istituto dei Sistemi Complessi, Sezione di Firenze, via Madonna del Piano 10, Sesto Fiorentino, 50019 Firenze, Italy
2) ISIS Facility, Rutherford Appleton Laboratory, Chilton, Didcot, Oxon OX11 0QX, United Kingdom (literal)
- Titolo
- Lattice vibrations of para-hydrogen impurities in a solid deuterium matrix: An inelastic neutron scattering study (literal)
- Abstract
- In the present study, we report inelastic neutron scattering measurements from para-hydrogen defects in solid
normal deuterium at three different concentrations (between 3% and 11%) using the time-of-flight spectrometer
TOSCA-II. The measured double-differential cross sections give access to the self-inelastic structure factors for
the H2 centers of mass. Corrected experimental data, analyzed through the Young-Koppel model and the
Gaussian approximation, are transformed into defect densities of phonon states, which come out to be broad,
structured, and nearly concentration independent. Two experimentally determined Bose-corrected spectral moments
are found to be in agreement with independent estimates, providing a strong validation of our data
reduction procedure. Subsequently, experimental phonon spectra are compared to three calculations, namely, a
simple harmonic model at infinite dilution, a more advanced harmonic model with concentration effects, and
finally a lattice dynamics simulation based on self-consistent phonon and coherent potential approximations.
However, while the first part of the defect spectral density, attributed to the propagating modes, turns out to be
roughly explained, the localized part is properly described by none of these models, except for its mean
frequency position. The large overall width appears so far impossible to be reproduced, representing a challenge
for the physicists involved in quantum dynamics simulations. (literal)
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