Allgemein

Publications

Stephan, S., Horsch, M. T., Vrabec, J., & Hasse, H. (2019). MolMod–an open access database of force fields for molecular simulations of fluids. Molecular Simulation, 45(10), 806-814. doi: 10.1080/08927022.2019.1601191 Abstract: The MolMod database is presented, which is openly accessible at http://molmod.boltzmann-zuse.de and contains intermolecular force fields for over 150 pure fluids at present. It was developed and is maintained by the Boltzmann-Zuse Society for Computational Molecular Engineering (BZS). The set of molecular models in the MolMod database provides a coherent…

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Fraunhofer-Institut für Fertigungstechnik
und Angewandte Materialforschung IFAM
– Klebtechnik und Oberflächen –

Wiener Straße 12 | 28359 Bremen
Telefon +49 421 2246-644 | Fax -430

Dr. Michael Hoffmann
Adhäsions- und Grenzflächenforschung
michael.hoffmann@ifam.fraunhofer.de
www.ifam.fraunhofer.de

Virtual Materials Marketplace | VIMMP

This Project has received funding from the European Union’s Horizon 2020 research and innovation programme under grant agreement No 760907.