Wednesday 2:15pm in the seminar room NC 03/399.
| Special date Thu 10. 10. 2019 15:00h ZEMOS 0.17 | Sonia Coriani, Department of Chemistry, University of Denmark, Copenhagen, Denmark Theoretical 'Beamlines' for Modern Spectroscopic Experiments (Joint seminar with EXC 2033 “RESOLV”) |
| 23. 10. 2019 | Michael Walter, Freiburg Centre for Interactive Materials and Bioinspired Technologies, University of Freiburg From bond rupture to weakly interacting systems - insights from density functional theory |
| 30. 10. 2019 | Oldamur Hollóczki, Mulliken Center for Theoretical Chemistry, Institut für Physikalische und Theoretische Chemie, Universität Bonn Nanoplastics from molecular dynamics simulations (Speaker Exchange Program Bonn/Bochum) |
| 06. 11. 2019 | Mihkel Ugandi, Lehrstuhl für Theoretische Chemie, Ruhr-Universität Bochum Exploration of excited state potential energy surfaces: computations and implementation |
| 13. 11. 2019 | Laura Durán Caballero, Lehrstuhl für Theoretische Chemie, Ruhr-Universität Bochum Quantum solvation of Molecules in para-hydrogen |
| 20. 11. 2019 | Reinhold Fink, Institut für Physikalische und Theoretische Chemie, Universität Tübingen Approaching chemical accuracy with second order perturbation theory by mixing RE and MP Hamiltonians and orbital optimization |
| 27. 11. 2019 | Benjamin Rotenberg, Laboratoire PHENIX, Sorbonne Université, Paris, France Electrode/electrolyte interfaces: insights from classical molecular simulations and applications to energy storage, blue energy harvesting and water desalination (Joint seminar with EXC 2033 “RESOLV”) |
| 04. 12. 2019 | Esma Birsen Boydas, Lehrstuhl für Theoretische Chemie, Ruhr-Universität Bochum Mechanistic insights into the reduction of carbon dioxide by supramolecular mixed-valent complexes from quantum chemical calculations |
| 18. 12. 2019 | Klaus-Robert Müller, Institute of Software Engineering and Theoretical Computer Science, Machine Learning, Technische Universität Berlin Machine Learning meets Quantum Chemistry (Joint seminar with EXC 2033 “RESOLV”) |
| 08. 01. 2020 | Ivano Tavernelli, IBM Zurich Research Laboratory, Zürich, Schweiz Quantum computing and its applications in chemistry and physics (Joint seminar with EXC 2033 “RESOLV”) |
| 15. 01. 2020 | Toon Verstraelen, Center for Molecular Modeling, Techlane Ghent Science Park, Campus Ardoyen, Zwijnaarde, Belgien Force Field Modeling of Short-Range Induction Interactions and Polarizable Atomic Monopoles (Joint seminar with EXC 2033 “RESOLV”) |
| 22. 01. 2020 | Samuli Ollila, Institute of Biotechnology, University of Helsinki, Finnland Combination of NMR Experiments and MD Simulations to Study Disordered Biomolecules (Joint seminar with EXC 2033 “RESOLV”) |
| 29. 01. 2020 | Birgit Strodel, Forschungzentrum Jülich, Biophysics and Soft Matter, Jülich Possibilities and current limitations of joining MD simulations and experiments (Joint seminar with EXC 2033 “RESOLV”) |
| Special date Wed 05. 02. 2020 | Sapna Sarupria, Chemical and Biomolecular Engineering, Clemson University, USA Pushing the limits of simulations of complex systems -- from nucleation to biomolecules, from rare event sampling to multiscale modeling (Joint seminar with EXC 2033 “RESOLV” and “Research Department Solvation Science”) |
Guests are most welcome!
The current seminar program for printing as a PDF file.
Previous seminar programs: SS19, WS18/19, SS18, WS17/18, SS17, WS16/17, SS16, WS15/16, SS15, WS14/15, SS14, WS13/14, SS13, WS12/13, SS12, WS11/12, SS11, WS10/11, SS10, WS09/10, SS09, WS08/09, SS08, WS07/08, SS07, WS06/07, SS06, WS05/06, SS05, WS04/05, SS04, WS03/04, SS03, WS02/03, SS02, WS01/02, SS01, WS00/01,
Festkolloquium SS06, Festkolloquium WS13/14
STC 2016 Programm, STC 2016 Homepage
