Projekte: Linux-Cluster zum wissenschaftlichen Hochleistungsrechnen

Javaid Akram, Sahar ; Meißner, Sophie ; Kümmel, Stephan:
Analyzing Electronic Excitations and Exciton Binding Energies in Y6 Films.
In: Advanced Functional Materials. (2025) . - 2419236.
DOI: https://doi.org/10.1002/adfm.202419236

Kaiser, Alexander ; Kümmel, Stephan:
Rethinking the Kohn–Sham inverse problem.
In: The Journal of Chemical Physics. Bd. 163 (2025) Heft 10 . - 104101.
DOI: https://doi.org/10.1063/5.0281993

Schelter, Ingo ; Förster, Johannes ; Richter, Rian ; Schild, Nils ; Kümmel, Stephan:
Analyzing energy transfer with density-functional theory in real time : Time scales for the energy transfer between B850 bacteriochlorophylls.
In: The Journal of Chemical Physics. Bd. 163 (2025) Heft 8 . - 084116.
DOI: https://doi.org/10.1063/5.0279181

Trepl, Thomas ; Schelter, Ingo ; Kümmel, Stephan:
Time-Resolved Ultrafast Excitation Dynamics in the B850 Light-Harvesting Antenna from Density Functional Theory.
In: The Journal of Physical Chemistry Letters. Bd. 16 (2025) . - S. 10891-10898.
DOI: https://doi.org/10.1021/acs.jpclett.5c02108