First-principles study on the role of Ti, V, and Sc catalysts in enhancing the catalytic effects of boron oxide monolayer for efficient Lithium-selenium batteries
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Publisher
Elsevier
Abstract
Please read abstract in the article.
Description
DATA AVAILABILITY : Data will be made available on request.
Keywords
Density functional theory (DFT), Shuttle effects, Polyselenides, Single-atom catalysts (SACs), Lithium‑selenium batteries (LiSeB), Boron monoxide monolayer, Boron monoxide monolayer
Sustainable Development Goals
SDG-07: Affordable and clean energy
Citation
Mapasha, R.E., Fwalo, C., Igumbor, E. et al. 2025, 'First-principles study on the role of Ti, V, and Sc catalysts in enhancing the catalytic effects of boron oxide monolayer for efficient Lithium-selenium batteries', FlatChem, vol. 53, art. 100918, doi : 10.1016/j.flatc.2025.100918.