Martin Thomas Horsch
Martin Thomas Horsch
UK Research and Innovation, Scientific Computing Department, STFC Daresbury Laboratory
Verified email at - Homepage
TitleCited byYear
ls1 mardyn: The Massively Parallel Molecular Dynamics Code for Large Systems
C Niethammer, S Becker, M Bernreuther, M Buchholz, W Eckhardt, ...
Journal of chemical theory and computation 10 (10), 4455-4464, 2014
Modification of the classical nucleation theory based on molecular simulation data for surface tension, critical nucleus size, and nucleation rate
M Horsch, J Vrabec, H Hasse
Physical Review E 78 (1), 011603, 2008
591 TFLOPS multi-trillion particles simulation on SuperMUC
W Eckhardt, A Heinecke, R Bader, M Brehm, N Hammer, H Huber, ...
International Supercomputing Conference, 1-12, 2013
The influence of the liquid slab thickness on the planar vapor–liquid interfacial tension
S Werth, SV Lishchuk, M Horsch, H Hasse
Physica A: Statistical Mechanics and its Applications 392 (10), 2359-2367, 2013
ms2: A molecular simulation tool for thermodynamic properties, new version release
CW Glass, S Reiser, G Rutkai, S Deublein, A Köster, G Guevara-Carrion, ...
Computer Physics Communications 185 (12), 3302-3306, 2014
Contact angle of sessile drops in Lennard-Jones systems
S Becker, HM Urbassek, M Horsch, H Hasse
Langmuir 30 (45), 13606-13614, 2014
Excess equimolar radius of liquid drops
M Horsch, H Hasse, AK Shchekin, A Agarwal, S Eckelsbach, J Vrabec, ...
Physical Review E 85 (3), 031605, 2012
Transport diffusivities of fluids in nanopores by non-equilibrium molecular dynamics simulation
H Frentrup, C Avendaño, M Horsch, A Salih, EA Müller
Molecular Simulation 38 (7), 540-553, 2012
Multicriteria optimization of molecular force fields by Pareto approach
K Stöbener, P Klein, S Reiser, M Horsch, KH Küfer, H Hasse
Fluid Phase Equilibria 373, 100-108, 2014
ms2: A molecular simulation tool for thermodynamic properties, release 3.0
G Rutkai, A Köster, G Guevara Carrión, T Janzen, M Schappals, ...
Computer Physics Communications 221, 343-351, 2017
Molecular modelling and simulation of the surface tension of real quadrupolar fluids
S Werth, K Stöbener, P Klein, KH Küfer, M Horsch, H Hasse
Chemical Engineering Science 121, 110-117, 2015
Homogeneous nucleation in supersaturated vapors of methane, ethane, and carbon dioxide predicted by brute force molecular dynamics
M Horsch, J Vrabec, M Bernreuther, S Grottel, G Reina, A Wix, K Schaber, ...
The Journal of chemical physics 128 (16), 164510, 2008
Contact Angle Dependence on the Fluid− Wall Dispersive Energy
M Horsch, M Heitzig, C Dan, J Harting, H Hasse, J Vrabec
Langmuir 26 (13), 10913-10917, 2010
Parametrization of two-center Lennard-Jones plus point-quadrupole force field models by multicriteria optimization
K Stöbener, P Klein, M Horsch, K Küfer, H Hasse
Fluid Phase Equilibria 411, 33-42, 2016
Interfacial and bulk properties of vapor-liquid equilibria in the system toluene+ hydrogen chloride+ carbon dioxide by molecular simulation and density gradient theory+ PC-SAFT
S Werth, M Kohns, K Langenbach, M Heilig, M Horsch, H Hasse
Fluid Phase Equilibria 427, 219-230, 2016
Hydrogen bonding of ethanol in supercritical mixtures with CO2 by 1H NMR spectroscopy and molecular simulation
S Reiser, N McCann, M Horsch, H Hasse
The Journal of Supercritical Fluids 68, 94-103, 2012
Grand canonical steady-state simulation of nucleation
M Horsch, J Vrabec
The Journal of chemical physics 131 (18), 184104, 2009
Long-range correction for multi-site Lennard-Jones models and planar interfaces
S Werth, G Rutkai, J Vrabec, M Horsch, H Hasse
Molecular Physics 112 (17), 2227-2234, 2014
Solvent activity in electrolyte solutions from molecular simulation of the osmotic pressure
M Kohns, S Reiser, M Horsch, H Hasse
The Journal of chemical physics 144 (8), 084112, 2016
Supercomputing for molecular dynamics simulations: handling multi-trillion particles in nanofluidics
A Heinecke, W Eckhardt, M Horsch, HJ Bungartz
Springer, 2015
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Articles 1–20