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Simon Stephan
Simon Stephan
RPTU Kaiserslautern
Verified email at rptu.de
Title
Cited by
Cited by
Year
Thermophysical properties of the Lennard-Jones fluid: Database and data assessment
S Stephan, M Thol, J Vrabec, H Hasse
Journal of chemical information and modeling 59 (10), 4248-4265, 2019
1312019
MolMod–an open access database of force fields for molecular simulations of fluids
S Stephan, MT Horsch, J Vrabec, H Hasse
Molecular Simulation 45 (10), 806-814, 2019
852019
ms2: A molecular simulation tool for thermodynamic properties, release 3.0
G Rutkai, A Köster, G Guevara-Carrion, T Janzen, M Schappals, ...
Computer Physics Communications 221, 343-351, 2017
832017
Equation of state for the Lennard-Jones truncated and shifted fluid with a cut-off radius of 2.5 σ based on perturbation theory and its applications to interfacial thermodynamics
M Heier, S Stephan, J Liu, WG Chapman, H Hasse, K Langenbach
Molecular Physics 116 (15-16), 2083-2094, 2018
772018
Vapor− liquid interface of the lennard-jones truncated and shifted fluid: comparison of molecular simulation, density gradient theory, and density functional theory
S Stephan, J Liu, K Langenbach, WG Chapman, H Hasse
The Journal of Physical Chemistry C 122 (43), 24705-24715, 2018
752018
Review and comparison of equations of state for the Lennard-Jones fluid
S Stephan, J Staubach, H Hasse
Fluid Phase Equilibria 523, 112772, 2020
722020
Enrichment at vapour–liquid interfaces of mixtures: Establishing a link between nanoscopic and macroscopic properties
S Stephan, H Hasse
International Reviews in Physical Chemistry 39 (3), 319-349, 2020
722020
Round robin study: Molecular simulation of thermodynamic properties from models with internal degrees of freedom
M Schappals, A Mecklenfeld, L Kröger, V Botan, A Köster, S Stephan, ...
Journal of chemical theory and computation 13 (9), 4270-4280, 2017
692017
Interfacial properties of binary Lennard-Jones mixtures by molecular simulation and density gradient theory
S Stephan, K Langenbach, H Hasse
The Journal of Chemical Physics 150 (17), 2019
652019
Influence of dispersive long-range interactions on properties of vapour–liquid equilibria and interfaces of binary Lennard-Jones mixtures
S Stephan, H Hasse
Molecular Physics 118 (9-10), e1699185, 2020
502020
Interfacial properties of binary mixtures of simple fluids and their relation to the phase diagram
S Stephan, H Hasse
Physical Chemistry Chemical Physics 22 (22), 12544-12564, 2020
482020
Molecular interactions at vapor-liquid interfaces: Binary mixtures of simple fluids
S Stephan, H Hasse
Physical Review E 101 (1), 012802, 2020
442020
Mass transfer through vapour–liquid interfaces: A molecular dynamics simulation study
S Stephan, D Schaefer, K Langenbach, H Hasse
Molecular Physics 119 (3), e1810798, 2021
422021
ms2: A molecular simulation tool for thermodynamic properties, release 4.0
R Fingerhut, G Guevara-Carrion, I Nitzke, D Saric, J Marx, K Langenbach, ...
Computer Physics Communications 262, 107860, 2021
402021
Vapor-liquid interfacial properties of the system cyclohexane+ CO2: Experiments, molecular simulation and density gradient theory
S Stephan, S Becker, K Langenbach, H Hasse
Fluid Phase Equilibria 518, 112583, 2020
392020
Molecular dynamics and phase field simulations of droplets on surfaces with wettability gradient
F Diewald, MP Lautenschlaeger, S Stephan, K Langenbach, C Kuhn, ...
Computer Methods in Applied Mechanics and Engineering 361, 112773, 2020
392020
The influence of lubrication and the solid–fluid interaction on thermodynamic properties in a nanoscopic scratching process
S Stephan, M Dyga, HM Urbassek, H Hasse
Langmuir 35 (51), 16948-16960, 2019
352019
Molecular dynamics simulation study of mechanical effects of lubrication on a nanoscale contact process
S Stephan, MP Lautenschläger, IA Alhafez, MT Horsch, HM Urbassek, ...
Tribology Letters 66, 1-13, 2018
332018
Enrichment of components at vapour-liquid interfaces: A study by molecular simulation and density gradient theory
S Stephan, K Langenbach, H Hasse
Chemical Engineering Transactions 69 (2018), 2018
262018
Characteristic curves of the Lennard-Jones fluid
S Stephan, UK Deiters
International journal of thermophysics 41, 1-24, 2020
252020
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Articles 1–20