12 citations · 16 across the 4 of their papers we have counts for
7 papers · 1 filter
Carbonyl sulphide under strong laser field: time-dependent density functional theory
G. Bilalbegovic
The first 52 fs of a time evolution of the electron density in OCS after an interaction with an intense sub 10 fs laser pulse are studied using the time-dependent density functiona…
Density functional theory study of (OCS)2^-
G. Bilalbegovic
The structural and electronic properties of the carbonyl sulfide dimer anion are calculated using density functional theory within a pseudopotential method. Three geometries are op…
Assemblies of gold icosahedra
G. Bilalbegovic
Low-dimensional free-standing aggregates of bare gold clusters are studied by the molecular dynamics simulation. Icosahedra of 55 and 147 atoms are equilibrated at T=300 K. Then, t…
Gold nanotube: structure and melting
G. Bilalbegovic
In the process of molecular dynamics simulation studies of gold nanowires an interesting structure is discovered. This is a finite double-wall nanowire with a large empty core simi…
Nanometer-scale capacitors
J. Stepanic, G. Bilalbegovic
Molecular dynamics computer simulations which employ the embedded-atom potential show that nanowires of gold exist as multishelled structures. We simulate double-walled gold nanowi…
Metallic nanowires: multi-shelled or filled ?
G. Bilalbegovic
The room temperature structure of aluminum, copper and gold infinite nanowires is studied. The molecular dynamics simulation method and the same type of the embedded atom potential…