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On the microscopic dynamics of the 'Einstein solids' AlV2Al20 and GaV2Al20, and of YV2Al20: a benchmark system for 'rattling' excitations

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Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP04005A, Paper
Open Access Open Access
Michael Marek Koza, Hannu Mutka, Yoshihiko Okamoto, Jun-ichi Yamaura, Zenji Hiroi
The inelastic response of AV2Al20 (with A = Al, Ga and Y) was probed by high-resolution inelastic neutron scattering experiments and density functional theory (DFT) based lattice dynamics calculations (LDC).
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