106 citations · 672 across the 28 of their papers we have counts for
4 papers · 1 filter
Molecular simulation of nano-dispersed fluid phases
Martin Horsch, Hans Hasse
Fluid phase equilibria involving nano-dispersed phases, where at least one of the coexisting phases is confined to a small volume, are investigated by molecular dynamics simulation…
Computational molecular engineering as an emerging technology in process engineering
Martin Horsch, Christoph Niethammer, Jadran Vrabec +1
The present level of development of molecular force field methods is assessed from the point of view of simulation-based engineering, outlining the immediate perspective for furthe…
Molecular modelling and simulation of electrolyte solutions, biomolecules, and wetting of component surfaces
Martin Horsch, Stefan Becker, Juan Manuel Castillo +6
Massively-parallel molecular dynamics simulation is applied to systems containing electrolytes, vapour-liquid interfaces, and biomolecules in contact with water-oil interfaces. Nov…
The influence of the liquid slab thickness on the planar vapor-liquid interfacial tension
Stephan Werth, Sergey Lishchuk, Martin Horsch +1
One of the long standing challenges in molecular simulation is the description of interfaces. On the molecular length scale, finite size effects significantly influence the propert…