Neudecker Group
? Uni BremenStrain analysis of a knotted polyethylene strand
? Uni BremenBonding analysis of iron-sulfur bonds
? Uni BremenEnergy contributions in a strain analysis
? Uni BremenRubredoxin with central FeS4 unit
? Uni BremenMechanochemical pressure model
? Uni BremenStrain analysis of 1,4-substituted triazole
? Uni BremenTime-resolved UV/VIS absorption spectrum of homotropylium
? Uni BremenStrain analysis of a derivative of Dewar benzene
? Uni BremenProtein force sensor
Welcome
In the Neudecker (formerly Stauch) group we focus on Theoretical and Computational Chemistry. We develop and apply quantum chemical methods for the calculation of spectroscopic properties of molecules under various external influences (e.g. mechanical force, pressure, temperature). Please refer to the Research page for more details.
X (Twitter): @NeudeckerGroup
News
July 31, 2025
In a new paper, we simulate the thermal and photochemical degradation of glyphosate on a titanium dioxide surface. Interestingly, mechanical deformation also plays a role. Many thanks to Filippo, Maria, Luca, Eric, Lucio, Wilke and Susi for this exciting collaboration.
July 15, 2025
Today, Janek starts his research internship in our group. He will work on emergent properties under pressure. Welcome, Janek.
July 03, 2025
Noah begins his Master’s thesis with Wilke. He will work on a machine learning algorithm for the characterization of surfaces. Welcome, Noah.
July 01, 2025
Marvin is starting his doctoral thesis in our group today. He will work on the methodological development of the JEDI analysis and use it for the simulation of deformed solids. Welcome, Marvin! We are looking forward to a lot of exciting science and would like to thank the Hans B?ckler Foundation for funding this project.
June 13, 2025
Chieh-Min has calculated the optical properties of some organic semiconductors and Tanja, Michael and Katharina have provided experimental reference data. You can find all details in our new preprint.
June 11, 2025
Chieh-Min's and Alexander's paper on the projected range of protons in materials has been accepted for publication. It turns out that Molecular Dynamics simulations can be used to model the penetration depth of protons in materials. Congrats, you two, on this exciting publication.
June 02, 2025
Maxi starts working on his Master’s thesis, in which he will investigate spin crossover processes. We’re looking forward to this exciting project.
April 14, 2025
Paul starts his research internship in our group, in which he will work on catalytic processes under pressure. Welcome, Paul.
April 11, 2025
Christoph successfully defends his Bachelor’s thesis. Congratulations, Christoph!
April 07, 2025
Annelene starts working on her Master’s thesis today, in which she will work on the connection between the JEDI strain analysis and real-time quantum chemistry. Welcome, Annelene.
Contact
Prof. Dr. Tim Neudecker
University of Bremen
Institute for Physical and Theoretical Chemistry
Leobener Str. 6, UFT, 1250
D-28359 Bremen, Germany
Tel.: +49 (0)421 218 50280
Email: neudeckerprotect me ?!uni-bremenprotect me ?!.de