International Workshop on Molecular Modeling and Simulation
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03-02-2021
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International Workshop on Molecular Modeling and Simulation
Tuesday – 03-02-2021
09:40
iCal
Interface processes I
Chair(s)
Dr. Martin Thomas Horsch (High Performance Computing Center Stuttgart (HLRS))
Room:
Virtual Room 1
Topic:
Form of presentation:
Lecture
Duration:
60 Minutes
09:40
Mass Flux Through Vapor-Liquid Interfaces: A Molecular Simulation Study
Dominik Schaefer | TU Kaiserslautern | Germany
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Authors:
Dominik Schaefer | TU Kaiserslautern | Germany
Juniorprofessor Simon Stephan | TU Kaiserslautern | Germany
Univ.-Prof. Dr.-Ing. Kai Langenbach | TU Kaiserslautern | Germany
Prof. Dr.-Ing. Hans Hasse | TU Kaiserslautern | Germany
10:00
Large scale molecular dynamics simulations and phase-field modeling of droplet coalescence
Matthias Heinen | TU Berlin | Germany
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Authors:
Prof. Dr. Jadran Vrabec | TU Berlin | Germany
Matthias Heinen | TU Berlin | Germany
10:20
Atomistic Simulation and Classical Density Functional Theory for Modeling Adsorption in Covalent Organic Frameworks
Christopher Keßler | Universität Stuttgart, Institut für Technische Thermodynamik und Thermische Verfahrenstechnik | Germany
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Authors:
Christopher Keßler | Universität Stuttgart, Institut für Technische Thermodynamik und Thermische Verfahrenstechnik | Germany
Johannes Eller | Universität Stuttgart, Institut für Technische Thermodynamik und Thermische Verfahrenstechnik | Germany
Prof. Dr. Niels Hansen | Universität Stuttgart, Institut für Technische Thermodynamik und Thermische Verfahrenstechnik | Germany
Prof. Dr.-Ing. Joachim Groß | Universität Stuttgart, Institut für Technische Thermodynamik und Thermische Verfahrenstechnik | Germany
11:00
iCal
Interface processes II
Chair(s)
Univ.-Prof. Dr.-Ing. Kai Langenbach (Universität Innsbruck)
Room:
Virtual Room 1
Topic:
Form of presentation:
Lecture
Duration:
60 Minutes
11:00
Properties of Vapor-Liquid Interfaces: Molecular Simulations, Density Gradient Theory, and Experiments
Oliver Großmann | TU Kaiserslautern | Germany
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Authors:
Oliver Großmann | TU Kaiserslautern | Germany
Juniorprofessor Simon Stephan | TU Kaiserslautern | Germany
Univ.-Prof. Dr.-Ing. Kai Langenbach | TU Kaiserslautern | Germany
Prof. Dr.-Ing. Hans Hasse | TU Kaiserslautern | Germany
11:20
Investigating evaporation processes with large molecular dynamics simulations
Simon Homes | TU Berlin | Germany
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Authors:
Simon Homes | TU Berlin | Germany
Prof. Dr. Jadran Vrabec | TU Berlin | Germany
11:40
Molecular Dynamics Simulations of Lubricated Contact Processes on the Nanoscale
Sebastian Schmitt | TU Kaiserslautern | Germany
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Authors:
Sebastian Schmitt | TU Kaiserslautern | Germany
Juniorprofessor Simon Stephan | TU Kaiserslautern | Germany
Prof. Dr.-Ing. Hans Hasse | TU Kaiserslautern | Germany