2 papers
cond-mat.mtrl-sci2010
Influence of surface chemistry on the electronic properties of graphene related carbon materials
Arunabhirm Chutia, Fanica Cimpoesu, Hideyuki Tsuboi +1
A theoretical study on the influence of organic functional groups on the electronic properties of graphene related carbon materials was carried out. Here we report, using density f…
cond-mat.mtrl-sci1999
Density-functional-theory calculations of molecular nitrogen on ruthenium cluster
Keshav N. Shrivastava, S. S. C. Ammal, H. Tsuruya +6
Density-functional-theory calculations for the adsorption of molecular nitrogen on ruthenium surface are reported. It is found that nitrogen molecule is adsorbed while standing per…