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Faculty Lectures (Fakultätskolloquium)

All those talks start at 16.00 in Carl Auer v. Welsbach Hörsaal, Währinger Straße 38, 1090 Wien.
Upcoming talks:

Date Name Title

Recent talks:

Date Name Title
12.06.2017 Prof. Dr. Andreas Grohmann / TU Berlin Complexes of „Superpodal“ Ligands-Reactivity and Function
12.06.2017 Prof. Leif Hammarström / Uppsala University 14:00!
Molecular and Biomimetic Approaches to Artificial Photosynthesis
08.05.2017 Prof. Manfred Scheer / Universität Regensburg, Deutschland The Magic of Polypnictogen Compounds
10.04.2017 Prof. Leonid Sazanov / IST Austria tba
06.03.2017 Prof. Razvan Stoian / Université de Saint-Étienne, Frankreich Multiscale dynamics and control in ultrafast laser nanostructuring; applications in 3D photonics


Group Seminar Talks (270041 SE Theoretical and Computational Chemistry)

These talks start Wednesday at 2 pm (exceptions are marked in red) in the seminar room at 4th floor, Währingerstraße 17, 1090 Wien.

Date Name Title

Recent talks:

Date Type Name Title
21.06.2017 SciSe Maximilian Menger Polarizable QM/classical Methods: From continuum to a discrete description
21.06.2017 LiSe Sandra Gómez 14:30!
tba
14.06.2017 SciSe 2 Davide Avagliano Acetone ultrafast relaxation from high energy Rydberg states
14.06.2017 LiSe Ludwig Schwiedrzik 15:30!
Differences in the Abilities to Mechanically Eliminate Activation Energies for Unimolecular and Bimolecular Reactions
14.06.2017 SciSe 1 Felix Plasser Surface Hopping Dynamics with a Linear Vibronic Coupling Model
07.06.2017 SciSe 1 Julia Westermayr Problems of Excited State Dynamics of Tyrosine using NNP
07.06.2017 SciSe2 Marius Bittermann Symmetry Functions for Neural Networks
17.05.2017 SciSe Sandra Gómez Can we use non-adiabatic dynamics to discriminate Nuclear Spin Isomers?
17.05.2017 LiSe Markus Oppel Comment and Response to Comment on “Density functional theory is straying from the path toward the exact functional”
10.05.2017 SciSe 1 Maximilian Meixner UV Absorption in dsDNA
10.05.2017 SciSe 2 Isolde Sandler Photodissociation of Phenol
10.05.2017 LiSe Andrew Atkins Femtosecond x-ray spectroscopy of an electrocyclic ring-opening reaction
03.05.2017 SciSe 1 Martina de Vetta Thermal Stability of Liposome Drug Carriers Investigated by Classical Molecular Dynamics
03.05.2017 SciSe 2 Michael Gastegger Fun with Machine Learning, Infrared Spectra and Quantum Chemistry
03.05.2017 LiSe Boris Maryasin Parameterization of phosphine ligands
reveals mechanistic pathways and predicts
reaction outcomes
26.04.2017 SciSe 1 Patrick Zobel Theoretical Chemistry Power Hour Part II – (Not so) Ultrafast Intersystem Crossing
26.04.2017 SciSe 2 Moritz Heindl Theoretical Chemistry Power Hour Part I – On Solvated Electrons and Hydrogen Radicals
26.04.2017 LiSe Philipp Marquetand Aggregation-induced intersystem crossing: a novel strategy for efficient molecular phosphorescence
05.04.2017 SciSe 1 Philipp Marquetand Ionization dynamics of halomethanes
05.04.2017 SciSe 2 Xinhua Xie Zero-photon dissociation of H2+ in two-color laser fields
05.04.2017 LiSe Felix Plasser Organic Electronics: Does a Plot of the HOMO-LUMO Wave Functions Provide Useful Information?
29.03.2017 SciSe 1 Sebastian Mai Absorption spectrum of [Re(CO)3(imidazole)(phen)]+: Solvation and Wave Function Analysis
29.03.2017 SciSe 2 Pedro Sánchez Murcia Theoretical study of photoactivatable Ru-diimine complexes in biological environments. Part II.
29.03.2017 LiSe Juanjo Nogueira Controlling Photorelaxation in Uracil with Shaped Laser Pulses: A
Theoretical Assessment.
22.03.2017 SciSe 2&3 Markus Koch Ultrafast processes in molecules studied by time-resolved
photoelectron-photoion coincidence spectroscopy
22.03.2017 SciSe 1 Francesco Talotta Ab initio investigation of trans-[RuCl(NO)(py)4]2+ photochemistry
08.03.2017 LiSe/SciSe Markus Oppel Network, Data, Gaussian, GPUS and the Cloud