Enhancement of lithiation on a graphane monolayer through extended H vacancy pathways : an ab initio study
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Date
Authors
Kgalema, Sentserere Phodisho
Diale, M. (Mmantsae Moche)
Igumbor, Emmanuel
Mapasha, Refilwe Edwin
Journal Title
Journal ISSN
Volume Title
Publisher
Elsevier
Abstract
Please read abstract in the article
Description
DATA AVAILABILITY : Data will be made available on request.
Keywords
Density functional theory (DFT), Graphane, Hydrogen vacancies, Lithiation potential, Storage capacity, Li-ions batteries
Sustainable Development Goals
Citation
Kgalema, S.P., Diale, M., Igumbor, E. & R.E. Mapasha, R.E. 2024, 'Enhancement of lithiation on a graphane monolayer through extended H vacancy pathways: an ab initio study', Physica B: Condensed Matter, vol. 673, art. 415490, pp. 1-8, doi : 10.1016/j.physb.2023.415490.