D. Carlier

activity

20032021

most citedSparse Cyclic Excitations Explain the Low Ionic Conductivity of Stoichiometric Li

_{7}

_{3}

_{2}

_{12}

93 citations · 158 across the 4 of their papers we have counts for

collaborators

Showing cond-mat.mtrl-sciShow all

3 papers · 1 filter

cond-mat.mtrl-sci2021★ 51 cited

Phase Stability and Sodium-Vacancy Orderings in a NaSICON Electrode

Ziliang Wang, Sunkyu Park, Zeyu Deng +7

We elucidate the thermodynamics of sodium (Na) intercalation into the sodium super-ionic conductor (NaSICON)-type electrode, Na $_{x}$ V $_{2}$ (PO $_{4}$ ) $_{3}$ , for promising Na-ion batteries…

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-sci2012★ 1 cited

Simulation of NMR Fermi contact shifts for Lithium battery materials: the need of an efficient hybrid functional approach

Yuesheng Zhang, Aurore Castets, Dany Carlier +2

In the context of the development of NMR Fermi contact shift calculations for assisting structural characterization of battery materials, we propose an accurate, efficient, and rob…

Phase Stability and Sodium-Vacancy Orderings in a NaSICON Electrode

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

Simulation of NMR Fermi contact shifts for Lithium battery materials: the need of an efficient hybrid functional approach

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