36 citations · 69 across the 8 of their papers we have counts for
4 papers · 1 filter
Excitation of Low-Frequency Modes and the Effects of Protein Dynamics on Spectral Densities of Bacteriochlorophyll Molecules
Sayan Maity, Tristan A. Mauck, Ulrich Kleinekathöfer
In the theory of open quantum systems, spectral densities are key quantities for modeling the dynamics and spectroscopic properties of the system under investigation. In the case o…
Excitation Energy Transfer between Porphyrin Dyes on a Clay Surface: A study employing Multifidelity Machine Learning
Dongyu Lyu, Matthias Holzenkamp, Vivin Vinod +5
Natural light-harvesting antenna complexes efficiently capture solar energy using chlorophyll, i.e., magnesium porphyrin pigments, embedded in a protein matrix. Inspired by this na…
Multi-Fidelity Machine Learning for Excited State Energies of Molecules
Vivin Vinod, Sayan Maity, Peter Zaspel +1
The accurate but fast calculation of molecular excited states is still a very challenging topic. For many applications, detailed knowledge of the energy funnel in larger molecular…
Time-Dependent Atomistic Simulations of the CP29 Light-Harvesting Complex
Sayan Maity, Pooja Sarngadharan, Vangelis Daskalakis +1
Light harvesting as the first step in photosynthesis is of prime importance for life on earth. For a theoretical description of photochemical processes during light harvesting, spe…