15 citations · 35 across the 3 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2018★ 8 cited
Structural evolution of amorphous polymeric nitrogen from \textit{ab initio} molecular dynamics simulations and evolutionary search
Dominika Melicherová, Oto Kohulák, Dušan Plašienka +1
Polymeric nitrogen with single bonds can be created from the molecular form at high pressure and due to large energy difference between triple and single bonds it is interesting as…
cond-mat.dis-nn2014★ 15 cited
Study of pressure-induced amorphization in sulfur using \textit{ab initio} molecular dynamics
Dušan Plašienka, Roman Martoňák
We report results of ab initio constant-pressure molecular dynamics simulations of sulfur compression leading to structural transition and pressure-induced amorphization. Starting…
cond-mat.mtrl-sci2013★ 12 cited
Structural evolution in high-pressure amorphous CO from \textit{ab initio} molecular dynamics
Dušan Plašienka, Roman Martoňák
By employing molecular dynamics simulations at constant pressure, we investigated behavior of amorphous carbon dioxide between 0-100 GPa and 200-500 K and found sever…