Research data supporting "Gaussian approximation potential modeling of lithium intercalation in carbon nanostructures"

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LiC_Fujikake_JCP_2018.zip (application/zip, 31Mb)

Authors

Fujikake, So

  Deringer, Volker

Lee, Taehoon

  Krynski, Marcin

Elliott, Stephen

  Csanyi, Gabor

Publication Date

2020-07-08

Type

Dataset

Metadata

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Citation

Fujikake, S., Deringer, V., Lee, T., Krynski, M., Elliott, S., & Csanyi, G. (2020). Research data supporting "Gaussian approximation potential modeling of lithium intercalation in carbon nanostructures" [Dataset]. https://doi.org/10.17863/CAM.54720

Description

interatomic potential to describe lithium inserted into low density amorphous carbon network

Format

data file is to be used together with the QUIP package http://www.github.com/libAtoms/QUIP

Keywords

amorphous materials, Gaussian approximation potentials, machine learning, lithium

Relationships

Publication Reference: https://doi.org/10.1063/1.5016317https://www.repository.cam.ac.uk/handle/1810/273598

Identifiers

This record's DOI: https://doi.org/10.17863/CAM.54720



Rights

Attribution-NonCommercial-ShareAlike 4.0 International, Attribution-NonCommercial-ShareAlike 4.0 International

Licence URL: http://creativecommons.org/licenses/by-nc-sa/4.0/http://creativecommons.org/licenses/by-nc-sa/4.0/