ESPResSo++: A modern multiscale simulation package for soft matter systems JD Halverson, T Brandes, O Lenz, A Arnold, S Bevc, V Starchenko, ... Computer Physics Communications 184 (4), 1129-1149, 2013 | 130 | 2013 |
Direct equilibration and characterization of polymer melts for computer simulations LA Moreira, G Zhang, F Müller, T Stuehn, K Kremer Macromolecular Theory and Simulations 24 (5), 419-431, 2015 | 94 | 2015 |
Equilibration of high molecular weight polymer melts: a hierarchical strategy G Zhang, LA Moreira, T Stuehn, KC Daoulas, K Kremer ACS Macro Letters 3 (2), 198-203, 2014 | 83 | 2014 |
Co-non-solvency: Mean-field polymer theory does not describe polymer collapse transition in a mixture of two competing good solvents D Mukherji, CM Marques, T Stuehn, K Kremer The Journal of chemical physics 142 (11), 2015 | 69 | 2015 |
Depleted depletion drives polymer swelling in poor solvent mixtures D Mukherji, CM Marques, T Stuehn, K Kremer Nature communications 8 (1), 1374, 2017 | 60 | 2017 |
Hierarchical modelling of polystyrene melts: from soft blobs to atomistic resolution G Zhang, A Chazirakis, VA Harmandaris, T Stuehn, KC Daoulas, ... Soft Matter 15 (2), 289-302, 2019 | 50 | 2019 |
ESPResSo++ 2.0: Advanced methods for multiscale molecular simulation HV Guzman, N Tretyakov, H Kobayashi, AC Fogarty, K Kreis, J Krajniak, ... Computer Physics Communications 238, 66-76, 2019 | 41 | 2019 |
Communication: One size fits all: Equilibrating chemically different polymer liquids through universal long-wavelength description G Zhang, T Stuehn, KC Daoulas, K Kremer The Journal of chemical physics 142 (22), 2015 | 24 | 2015 |
Scalable and fast heterogeneous molecular simulation with predictive parallelization schemes HV Guzman, C Junghans, K Kremer, T Stuehn Physical Review E 96 (5), 053311, 2017 | 11 | 2017 |
Computer Simulation Studies in Condensed Matter Physics vol 13, ed DP Landau, SP Lewis and HB Schüttler W Kob, C Brangian, T Stühn, R Yamamoto Berlin: Springer) p, 2000 | 5 | 2000 |
Code modernization strategies for short-range non-bonded molecular dynamics simulations J Vance, ZH Xu, N Tretyakov, T Stuehn, M Rampp, S Eibl, C Junghans, ... Computer Physics Communications 290, 108760, 2023 | 3 | 2023 |
Methoden zur Equilibrierung unterkühlter Flüssigkeiten T Stühn | 3 | 2000 |
Molekulardynamik-Computersimulation einer amorph-kristallinen SiO2-Grenzschicht T Stühn Mainz, Univ., Diss., 2005, 2005 | 2 | 2005 |
Equilibrating Glassy Systems with Parallel Tempering W Kob, C Brangian, T Stühn, R Yamamoto Computer Simulation Studies in Condensed-Matter Physics XIII: Proceedings of …, 2001 | 1 | 2001 |
ColBuilder: Flexible structure generation of crosslinked collagen fibrils D Monego, M Brosz, J Buck, V Viliuga, J Jung, T Stuehn, M Schmies, ... bioRxiv, 2024.12. 10.627782, 2024 | | 2024 |
Molecular Dynamics Study of the Glass Transition of Highly Entangled Polymer Melts HP Hsu, T Stuehn, KC Daoulas, K Kremer | | 2022 |
Implementation and Parallel Optimization of the Lees-Edwards Boundary Condition in ESPResSo++ ZH Xu, J Vance, N Tretyakov, T Stuehn, A Brinkmann arXiv preprint arXiv:2109.11083, 2021 | | 2021 |
Hierarchical Modelling of Entangled Polymer Melts: Structure and Rheology HP Hsu, G Zhang, T Stuehn, KC Daoulas, K Kremer NIC Symposium 2018, 2018 | | 2018 |
Rapid heterogeneous molecular simulation in time and space with parsemonious domain decomposition scheme HA Vargas Guzman, K Kremer, T Stuehn APS March Meeting Abstracts 2018, C38. 002, 2018 | | 2018 |
Scalable and fast concurrent multiscale molecular simulation with predictive parallelization scheme HV Guzman, C Junghans, K Kreis, A Fogarty, K Kremer, T Stuehn APS March Meeting Abstracts 2017, F26. 006, 2017 | | 2017 |