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Nr. Titel Autor Jahr
1 Electronic structure of intercalated epitaxial graphene: A first principles study Unigarro, Andres et al. 2025
2 Geometry and electronics of helical nanostructures Shabani, Faezeh et al. 2025
3 Self-Assembly Kinetics of Polyalanine α-helix Monolayers: Insights from Coarse-Grained Molecular Dynamics Simulations Ghodrati Saeini, Hadis et al. 2025
4 Calculation of inter-molecular transition rates depending on structural parameters with DFTB Teichert, Fabian et al. 2024
5 Electronic structure of intercalated epitaxial graphene: A first principles study Unigarro, Andres Pena et al. 2024
6 Migration in ländlichen Räumen Europas: Eine Bestandsaufnahme aktueller Forschungen Günther, Florian et al. 2024
7 Multi-scale simulation of structural motifs in assemblies of helical molecules Preis, Kevin et al. 2024
8 SIMULATED ANNEALING: EFFECTIVE BUT INEFFICIENT? A CASE STUDY OF THE HP MODEL OF PROTEIN FOLDING SHOWING HOW SIMPLE EXTENSIONS CAUSE A STRONG ACCELERATION Möbius, Arnulf* et al. 2024
9 Implementation and simulation of drift-diffusion models for organic mixed conductor devices Peña Unigarro, Andres David et al. 2023
10 Simulation of proximity effects in epitaxial graphene systems Pena Unigarro, Andres David et al. 2023
11 Stretch Evolution of Electronic Coupling of the Thiophenyl Anchoring Group with Gold in Mechanically Controllable Break Junctions Lokamani, Mani* et al. 2023
12 The self-assembly process of helical molecules Nguyen, Thi N. Ha et al. 2023
13 Organogels from Diketopyrrolopyrrole Copolymer Ionene/Polythiophene Blends Exhibit Ground-State Single Electron Transfer in the Solid State Stegerer, Dominik et al. 2022
14 Electron Mobility of Diketopyrrolopyrrole Copolymers Is Robust against Homocoupling Defects Wang, Qian et al. 2021
15 Evolution of Molecular Binding in Mechanically Controlled Break-Junctions Lokamani, Mani et al. 2021
16 Hydrogen Bonds Control Single-Chain Conformation, Crystallinity, and Electron Transport in Isoelectronic Diketopyrrolopyrrole Copolymers Wang, Qian et al. 2021
17 Electronic transport through PEB betweenAu(111) facets: A high-throughput Study Lokamani, Mani et al. 2020
18 Modeling the complex band structure of conjungated polymers via Kronig-Penney-like models Günther, Florian et al. 2020
19 Tuning the conductance of a molecular wire by the interplay of donor and acceptor units Skidin, Dmitry et al. 2018
20 Structure optimisation by thermal cycling for the hydrophobic-polar lattice model of protein folding Günther, Florian et al. 2017
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