114 citations · 573 across the 13 of their papers we have counts for
Showing 2021Show all
2 papers · 1 filter
cond-mat.mtrl-sci2021★ 108 cited
Exploring yttrium doped C fullerene as a high-capacity reversible hydrogen storage material: DFT investigations
Vikram Mahamiya, Alok Shukla, Brahmananda Chakraborty
By employing the state-of-the-art density functional theory, we report the hydrogen storage capability of yttrium decorated C fullerene. Single Y atom attached on C f…
cond-mat.mtrl-sci2021★ 93 cited
Scandium decorated C fullerene as high capacity reversible hydrogen storage material: Insights from density functional theory simulations
Vikram Mahamiya, Alok Shukla, Brahmananda Chakraborty
Using first-principles density functional theory simulations, we have observed that the scandium decorated C fullerene can adsorb up to six hydrogen molecules with an averag…