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Mass Transfer through Vapor-Liquid Interfaces Studied by Non-Stationary Molecular Dynamics Simulations.
J Phys Chem B. 2023 Mar 23;127(11):2521-2533. doi: 10.1021/acs.jpcb.2c08752. Epub 2023 Mar 10.
J Phys Chem B. 2023.
PMID: 36896991
Molecular Dynamics Study of Wetting and Adsorption of Binary Mixtures of the Lennard-Jones Truncated and Shifted Fluid on a Planar Wall.
Heier M, Stephan S, Diewald F, Müller R, Langenbach K, Hasse H.
Heier M, et al. Among authors: langenbach k.
Langmuir. 2021 Jun 22;37(24):7405-7419. doi: 10.1021/acs.langmuir.1c00780. Epub 2021 Jun 7.
Langmuir. 2021.
PMID: 34097830
Free PMC article.
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Interfacial properties of binary Lennard-Jones mixtures by molecular simulation and density gradient theory.
Stephan S, Langenbach K, Hasse H.
Stephan S, et al. Among authors: langenbach k.
J Chem Phys. 2019 May 7;150(17):174704. doi: 10.1063/1.5093603.
J Chem Phys. 2019.
PMID: 31067907
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Three-dimensional phase field modeling of inhomogeneous gas-liquid systems using the PeTS equation of state.
Diewald F, Heier M, Horsch M, Kuhn C, Langenbach K, Hasse H, Müller R.
Diewald F, et al. Among authors: langenbach k.
J Chem Phys. 2018 Aug 14;149(6):064701. doi: 10.1063/1.5035495.
J Chem Phys. 2018.
PMID: 30111148
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