Université de Bordeaux

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19922026

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Showing 2015 · cond-mat.mtrl-sciShow all

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cond-mat.mtrl-sci2015★ 31 cited

Optical response of silver clusters and their hollow shells from Linear-Response TDDFT

Peter Koval, Federico Marchesin, Dietrich Foerster +1

We present a study of the optical response of compact and hollow icosahedral clusters containing up to 868 silver atoms by means of time-dependent density functional theory. We hav…

cond-mat.mtrl-sci2015★ 93 cited

Sparse Cyclic Excitations Explain the Low Ionic Conductivity of Stoichiometric Li $_{7}$ La $_{3}$ Zr $_{2}$ O $_{12}$

Mario Burbano, Dany Carlier, Florent Boucher +2

We have performed long time-scale molecular dynamics simulations of the cubic and tetragonal phases of the solid lithium-ion--electrolyte Li $_{7}$ La $_{3}$ Zr $_{2}$ O $_{12}$ (LLZO), u…

cond-mat.mtrl-sci2015★ 44 cited

Resonant and Non-Local Properties of Phononic Metasolids

Daniel Torrent, Yan Pennec, Bahram Djafari-Rouhani

We derive a general theory of effective properties in metasolids based on phononic crystals with low frequency resonances. We demonstrate that in general these structures need to b…

Optical response of silver clusters and their hollow shells from Linear-Response TDDFT

Sparse Cyclic Excitations Explain the Low Ionic Conductivity of Stoichiometric Li7​La3​Zr2​O12​

Resonant and Non-Local Properties of Phononic Metasolids

Sparse Cyclic Excitations Explain the Low Ionic Conductivity of Stoichiometric Li $_{7}$ La $_{3}$ Zr $_{2}$ O $_{12}$