Theory Chemistry Seminars - Department of Chemistry
Theoretical Chemistry Seminars
The plan is that Fridays, a speaker will give a presentation about his/her research.
This is the time format we have:
20 min + 10 min discussion for internal speakers
30 min + 10 min discussion for external speakers
Place: D3-114 (Onsager) + Microsoft Teams/Zoom (if possibe)
Schedule
17.02.2023 , 14h15
Speaker: Matteo Castagnola
Title: TBA
10.02.2023 , 14h15
Speaker: Sara Angelico
Title: TBA
03.02.2023 , 14h15
Speaker: Gaston Courtade
Title: Combining experiments and simulations to understand multidomain proteins
27.01.2023 , 14h15
Speaker: Gunnar Lange
Title: What can topology do for you?
Topological ideas have become increasingly relevant in physics, chemistry and material science in recent years. Topology can help explain existing experimental data, and can also guide and open new avenues of research.
In this talk, I will give a broad overview of topological ideas both in the context of my own research in band topology, and in a wider context. I will also discuss how light-matter coupling can impact topology, and vice-versa.
13.01.2023 , 14h15
Speaker: Lu Xia
Title: Interactions between point defects and internal interfaces in bismuth ferrite
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04.11.2022 , 14h15
Speaker: John Philbin fra UCLA, California
Title: From superradiant nanomaterials to ultracold molecules
28. October 2022 , 14h15
Speaker: Marcus Takvam Lexander
Title: Dynamics in QED Cavities
21. October 2022 , 14h15
Speaker: Tor Strømsem Haugland
Title: Application of computer aided derivation and code generation for CCSDT and QED-CCSD
17. October 2022 , 10h30
Speaker: Trond Saue, CNRS --- Université Toulouse III-Paul Sabatier
Title: Does chemistry need more physics?
14. October 2022 , 14h15
Speaker: Eirik Falck da Silva, SINTEF
Title: Applications of Computational Chemistry in Solvent Based Separations
07. October 2022 , 14h15
Speaker: Titus Van Erp
Title: Exchanging replicas with unequal cost, infinitely and permanently
Authors: Sander Roet, Daniel T. Zhang, and Titus S. van Erp
30. September 2022 , 14:15
Speaker: Bendik S. Sannes
Title: Spin-adapted open-shell Coupled Cluster theory
23. September 2022 , 14:15
Speaker: Lukas Baldauf
Title: A coarse-grained model for alginate hydrogels
24. June 2022 , 14:00 + Teams
Speaker: Konrad Wilke
Title: : Investigation of the molecular mechanism of sodium chloride dissociation in water with rare event simulations
26. November 2021
Speaker: Sander Roet
Title: ∞RETIS: hairy business
19. November 2021
Speaker: Regina Matveeva
Title: Grand Canonical Hartree-Fock
12. November 2021
Speaker: Jocelyne Vreede, University of Amsterdam, Zoom meeting
Title: Sampling rare events in biomolecular systems
5. November 2021
Speaker: Rosario Roberto Riso
Title: Fully consistent MO theory in QED environments
29. October 2021
Speaker: Prof. An Ghysels
IBiTech – BioMMeda research group, Ghent University, Belgium
https://www.ugent.be/ea/ibitech/en/research/biommeda
Title: Permeability of small molecules through membranes from computer simulations
22. October 2021
Speaker: Alex Paul
Title: Efficient algorithms for coupled cluster with approximate triples for larger molecular systems
15. October 2021
Speaker: Daniel Zhang
Title: Path sampling and redox reactions