15 citations · 29 across the 3 of their papers we have counts for
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cond-mat.mtrl-sci2009★ 14 cited
Melting of hexane monolayers adsorbed on graphite: the role of domains and defect formation
C. Wexler, L. Firlej, B. Kuchta +1
We present the first large-scale molecular dynamics simulations of hexane on graphite that completely reproduces all experimental features of the melting transition. The canonical…
cond-mat.mtrl-sci2009
Cross-over mechanism of the melting transition in monolayers of alkanes adsorbed on graphite and the universality of energy scaling
L. Firlej, B. Kuchta, M. W. Roth +1
The interplay between the torsional potential energy and the scaling of the 1-4 van der Waals and Coulomb interactions determines the stiffness of flexible molecules. In molecular…
cond-mat.mtrl-sci2008★ 15 cited
Structural and phase properties of tetracosane (C24H50) monolayers adsorbed on graphite. Explicit Hydrogen Molecular Dynamics study
L. Firlej, B. Kuchta, M. W. Roth +2
We discuss Molecular Dynamics (MD) computer simulations of tetracosane (C24H50) monolayer physisorbed onto a graphite surface. The alkane molecules are simulated with explicit hydr…