Name:
17) Laurin Pollesböck
Aminolactonization of Exocyclic Olefins: A Mechanistic Study
29.04.2021

16) Vera Brieskorn
Testing the Applicability of Linearly corrected Dipole Moments in a Linear Vibronic coupling Model
19.04.2021

15) Julia Franz
Investigation of the Absorption Spectra of Two Redox Active Dithio Rhenium-complexes
07.02.2021

14) Thomas Knoll
Excited State Dynamics of Luminescent V(III) Complex
19.12.2020

13) Robert Strothmann
Initial Conditions Sampling to Setup a Excited State Dynamics QM/MM Study of Spiropyran Derivative
15.10.2020

12) Lukas Brandfellner
Studying Pyrrole in an Electric Field
07.09.2020

11) Chiara Luna Onorati
Theoretical Investigation of the Ligand Exchange and Deactivation Energetics in the [Ru(tpy)(bpy)] and [Ru(tpy)(dppz)] Catalysts
22.07.2020

10) Richard Jacobi
Investigations on the Interaction and Electron Transfer between the [Ru(bpyC17(bpy2]+2 Complex inserted in a Lipid Membrane and Ascorbate
22.03.2020

9) Stephan Reichl
The Lord of NNMT - A Mathematician's Journey Through Organic Chemistry
25.12.2019

8) Anna Karina Bäck
Supramolecular Arrangement of Tetracarboxylic Acids and its Properties: Energy, Planarity, Rotation
30.09.2019

7) Anna Karina Bäck
Analysis of Electronic Excitations in two Transition Metal Complexes, [Re(bpyS-S)(py)(CO)3]+ and [Ir(ppy)2(bpyS-S)]+
15.07.2019

6) Maximilian Tiefenbacher
Performance analysis of quantum chemistry programs on a vector processor
01.07.2019

5) Florian Jörg
Development of a Neural Network for Tyrosine
01.03.2019

4) Lisa Panzenböck
Development of a Neural Network for Tyrosine
01.03.2019

3) Dóra Vörös
Ultrafast Excited-State Decays in α-Diimine Transition Metal Complexes investigated with Linear Vibronic Coupling model within the Surface Hopping dynamics approach
11.02.2019

2) András Szabadi
The Importance of Quantum Effects in PtBr 26 While Using an LVC Hamiltonian
20.01.2019

1) Leopold Lindenbauer
Exact Simulations including Explicit Laser Pulses on a 1-Dimensional Model System of Pyrrole
07.01.2019