Wortmarke der Ruhr-Universität Bochum

Center for Theoretical Chemistry

Theoretical Chemistry Colloquia (SS 2024)

Wednesday 2:15pm in the seminar room NC 5/99.

10. 04. 2024    Thomas Gasevic, Mulliken Center for Theoretical Chemistry, Universität Bonn
Comprehensive Computational Studies of NMR Chemical Shifts for Group 14 Elements
(Speaker Exchange Program Bonn/Bochum)
17. 04. 2024    Michal Kochmann, Institute of Physical Chemistry, Polish Academy of Sciences
Theory meets ultrafast spectroscopy: photophysics of donor-acceptor compounds
(Joint seminar with EXC 2033 “RESOLV”)
Special date
24. 04. 2024
14:15, ZEMOS 0.17/0.19   
Chiara Cappelli, Scuola Normale Superiore, Pisa, Italy
Multiscale Modeling of Spectroscopy in Complex Environments
(Joint seminar with EXC 2033 “RESOLV”)
08. 05. 2024    Motoyuki Shiga, Japan Atomic Energy Agency
Recent progress in ab initio path integral molecular dynamics
(Joint seminar with EXC 2033 “RESOLV”)
15. 05. 2024
Christoph Jacob, Theoretische Chemie, TU Braunschweig
Quantum-Chemical Calculation of Two-Dimensional Infrared Spectra
(Joint seminar with EXC 2033 “RESOLV")
29. 05. 2024    Lukas Stelzl, Institute of Physics, JGU Mainz
Specific recognition and regulation by phase-separated condensates of disordered proteins: a simulations perspective
(Joint seminar with EXC 2033 “RESOLV”)
12. 06. 2024    Harald Oberhofer, Theoretische Physik IV, Universität Bayreuth
Simulating Charge Transport from First Principles to Machine Learning
(Joint seminar with EXC 2033 “RESOLV”)
19. 06. 2024    Stefan Goedecker, Department of Physics and Astronomy, University of Basel, Switzerland
Exploring the potential energy surface with Minima Hopping to study the synthesizability of materials
(Joint seminar with EXC 2033 “RESOLV”)
26. 06. 2024    Paul Popelier, Computational and Theoretical Chemistry, Universit of Manchester, UK
FFLUX or How to spend years constructing a novel force field based on Quantum Topological Atoms
(Joint seminar with EXC 2033 “RESOLV”)
03. 07. 2024    Tucker Carrington, Department of Chemistry, Queen's University, Ontario, Canada
Using collocation to solve the vibrational Schroedinger equation without computing integrals
(Joint seminar with EXC 2033 “RESOLV”)
10. 07. 2024    Andreas Grüneis, Technische Universität Wien
Recent developments in applying periodic coupled cluster theory to condensed matter systems
(Joint seminar with EXC 2033 “RESOLV”)

Guests are most welcome!

The current seminar program for printing as a PDF file.
Previous seminar programs: WS23/24, SS23, WS22/23, SS22, WS21/22, SS21, WS20/21, SS20, WS19/20, 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

Related Seminars:

HLN Colloquium

Chemistry Colloquium (GDCh)

Physics Colloquium