Nanotechnology · 2009 · 104 citations · 44 references
Natural SciencesMaterials SciencePhysicsCondensed Matter PhysicsNanotechnologySurface ScienceAtomic PackingAtomistic SimulationGraphene NanomaterialsMolecular DynamicsMolecular SimulationThermodynamics Of NanomaterialsFinite-temperature EffectsFinite-temperature SimulationsGrapheneGraphene MaterialsGraphene NanostructuresMolecular Dynamics Of MaterialsTemperature-dependent DynamicsThermodynamics Of Nanoclusters
The formation of atomic nanoclusters on suspended graphene sheets has been investigated by employing a molecular dynamics simulation at finite temperature. Our systematic study is based on temperature-dependent molecular dynamics simulations of some transition and alkali atoms on suspended graphene sheets. We find that the transition atoms aggregate and make various size nanoclusters distributed randomly on graphene surfaces. We also report that most alkali atoms make one atomic layer on graphene sheets. Interestingly, the potassium atoms almost deposit regularly on the surface at low temperature. We expect from this behavior that the electrical conductivity of a suspended graphene doped by potassium atoms would be much higher than in the case doped by the other atoms at low temperature.
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