Raw data for the dissertation "Structural and Electrical Properties of Molecule-Linked Gold Nanoparticle Assemblies - A Single Interface Model", carried out in the period from November 2021 to November 2024 in the Institute of Inorganic and Applied Chemistry in the group of Prof. Dr. Carmen Herrmann, Faculty of Mathematics, Informatics and Natural Science, University of Hamburg and in the Graduate School 2536 "Nanohybrid" funded by the Deutsche Forschungsgemeinschaft (DFG). The data set includes MD Simulations, DFT calculations, and charge transport calculations.

{"references": ["K. Schaefer, C.-Y. Liu et al. J. Phys. Chem. C 2024, 128 (9), 3994-4008, DOI: 10.1021/acs.jpcc.3c07646", "G. Mitra et al. Chem, 2025, 102500, https://doi.org/10.1016/j.chempr.2025.102500"]}