Supporting data for Sparse Cyclic Excitations Explain the Low Ionic Conductivity of Stoichiometric Li7La3Zr2O12

Supporting data for Sparse Cyclic Excitations Explain the Low Ionic Conductivity of Stoichiometric Li7La3Zr2O12

This Jupyter notebook, and the accompanying data, constitute supporting data for "Sparse Cyclic Excitations Explain the Low Ionic Conductivity of Stoichiometric Li7La3Zr2O12", Burbano et al. Phys. Rev. Lett. 116 135901 (2016) (https://doi.org/10.1103/PhysRevLett.116.135901). This dataset reproduces the steps taken in order to generate Figure S3 (d) in the "Validation of the Interatomic Potential" section of the Supplemental Information for this article.

Cite this dataset as:
Burbano, M., Carlier, D., Boucher, F., Morgan, B., Salanne, M., 2017. Supporting data for Sparse Cyclic Excitations Explain the Low Ionic Conductivity of Stoichiometric Li7La3Zr2O12. University of Bath. https://doi.org/10.15125/BATH-00366.

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Data

burbano_etal_20 ... orting_data.zip
application/zip (19kB)

Creators

Mario Burbano
Université de Bordeaux

Dany Carlier
Université de Bordeaux

Florent Boucher
Université de Nantes

Benjamin Morgan
University of Bath

Mathieu Salanne
Sorbonne Universités

Documentation Files

README.md
text/plain (2kB)

Funders

Dr B Morgan URF - Modelling Collective Lithium-Ion Dynamics in Battery Materials
UF130329

French National Research Agency

EoCoE

Publication details

Publication date: 2017
by: University of Bath

Version: 1

DOI: https://doi.org/10.15125/BATH-00366

URL for this record: https://researchdata.bath.ac.uk/id/eprint/366

Related articles

Burbano, M., Carlier, D., Boucher, F., Morgan, B. J. and Salanne, M., 2016. Sparse Cyclic Excitations Explain the Low Ionic Conductivity of StoichiometricLi7La3Zr2O12. Physical Review Letters, 116(13). Available from: https://doi.org/10.1103/PhysRevLett.116.135901.

Contact information

Please contact the Research Data Service in the first instance for all matters concerning this item.

Contact person: Benjamin Morgan

Departments:

Faculty of Science
Chemistry