19 citations · 55 across the 22 of their papers we have counts for
22 papers
The DFT and molecular dynamics multiscale study of the corrugation of graphene on Ru(0001): the unexpected stability of the moire-buckled structure
P. Süle
Results from first principles density functional theory (DFT) calculations and classical molecular dynamics (CMD) simulations are presented on moire-corrugation of graphene (gr). W…
Anomalous nanoscale diffusion in Pt/Ti: superdiffusive intermixing
P. Süle, M. Menyhárd
Probing the anomalous nanoscale intermixing using molecular dynamics (MD) simulations in Pt/Ti bilayer we characterize the superdiffusive nature of interfacial atomic transport. In…
Time-lapsed graphene moiré superlattice on Cu(111)
P. Süle, M. Szendrő
The detailed study of the graphene (gr) moiré superlattices emerging due to the mismatch between the substrate's and gr-overlayer crystal lattices is inevitable because of its high…
Fe impurity induced ion-nanopatterning: atomistic simulations using a new force field for FeSi
P. Süle
The ion-bombardment induced nanopatterning of Si(001) has been simulated by atomistic simulations with and without Fe impurity. The surface contamination has been simulated by usin…
Bond order potential for FeSi
P. Süle
A new parameter set has been derived for FeSi using the Albe-Erhart-type bond order potential (BOP) and the PONTIFIX code for fitting the parameters on a large training set of vari…
Lévy-flight intermixing: anomalous nanoscale diffusion in Pt/Ti
P. Süle, M. Menyhárd
Probing the anomalous nanoscale intermixing using molecular dynamics (MD) simulations in Pt/Ti bilayer we reveal the superdiffusive nature of interfacial atomic transport. It is sh…