659 citations · 983 across the 14 of their papers we have counts for
Showing 2011Show all
2 papers · 1 filter
cond-mat.mtrl-sci2011★ 16 cited
First-principles modeling of the polycyclic aromatic hydrocarbons reduction
D. W. Boukhvalov, X. Feng, K. Müllen
Density functional theory modelling of the reduction of realistic nanographene molecules (C42H18, C48H18 and C60H24) by molecular hydrogen evidences for the presence of limits in t…
cond-mat.mes-hall2011★ 28 cited
Oxygen adsorption effect on magnetic properties of graphite
D. W. Boukhvalov, S. Moehlecke, R. R. da Silva +1
Both experimental and theoretical studies of the magnetic properties of micrographite and nanographite indicate a crucial role of the partial oxidation of graphitic zigzag edges in…