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Susanne Leitherer
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Single-molecule junctions with epitaxial graphene nanoelectrodes
K Ullmann, PB Coto, S Leitherer, A Molina-Ontoria, N Martín, M Thoss, ...
Nano letters 15 (5), 3512-3518, 2015
1092015
Charge transport in pentacene–graphene nanojunctions
IA Pshenichnyuk, PB Coto, S Leitherer, M Thoss
The journal of physical chemistry letters 4 (5), 809-814, 2013
592013
Effect of structure and disorder on the charge transport in defined self-assembled monolayers of organic semiconductors
T Schmaltz, B Gothe, A Krause, S Leitherer, HG Steinrück, M Thoss, ...
ACS nano 11 (9), 8747-8757, 2017
382017
Modeling charge transport in c60-based self-assembled monolayers for applications in field-effect transistors
S Leitherer, CM Jäger, M Halik, T Clark, M Thoss
The Journal of Chemical Physics 140 (20), 2014
252014
Simulation of charge transport in organic semiconductors: A time-dependent multiscale method based on nonequilibrium Green's functions
S Leitherer, CM Jäger, A Krause, M Halik, T Clark, M Thoss
Physical Review Materials 1 (6), 064601, 2017
182017
Electric-field control of a single-atom polar bond
M Omidian, S Leitherer, N Néel, M Brandbyge, J Kröger
Physical Review Letters 126 (21), 216801, 2021
172021
Nonequilibrium bond forces in single-molecule junctions
J Brand, S Leitherer, NR Papior, N Néel, Y Lei, M Brandbyge, J Kröger
Nano Letters 19 (11), 7845-7851, 2019
172019
Removing all periodic boundary conditions: Efficient nonequilibrium Green's function calculations
N Papior, G Calogero, S Leitherer, M Brandbyge
Physical Review B 100 (19), 195417, 2019
162019
Charge transport in C 60-based single-molecule junctions with graphene electrodes
S Leitherer, PB Coto, K Ullmann, HB Weber, M Thoss
Nanoscale 9 (21), 7217-7226, 2017
142017
Current-induced atomic forces in gated graphene nanoconstrictions
S Leitherer, N Papior, M Brandbyge
Physical Review B 100 (3), 035415, 2019
132019
Ab initio current-induced molecular dynamics
JT Lü, S Leitherer, NR Papior, M Brandbyge
Physical Review B 101 (20), 201406, 2020
112020
Simple approach to current-induced bond weakening in ballistic conductors
N Papior, S Leitherer, M Brandbyge
Physical Review B 106 (15), 155401, 2022
52022
Electromigration Forces on Atoms on Graphene Nanoribbons: The Role of Adsorbate–Surface Bonding
S Leitherer, M Brandbyge, GC Solomon
JACS Au 4 (1), 189–196, 2023
12023
Charge Transport in Carbon-Based Nanostructures
S Leitherer
Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), 2017
12017
Simulation of Charge Transport using Complex Absorbing Potentials: Methodology and Applications to Molecule-Graphene Nanojunctions
S Leitherer
12012
Strong current in carbon nanoconductors: Mechanical and magnetic stability
S Leitherer, N Papior, M Brandbyge
Carbon 232, 119708, 2025
2025
High Molecular Conductance and Inverted Conductance Decay over 3 nm in Aminium-Terminated Carbon-Bridged Oligophenylene-Vinylenes
LKI Rieger, S Leitherer, W Bro-Jo̷rgensen, GC Solomon, RF Winter
Journal of the American Chemical Society, 2024
2024
Electric Field-Induced Sequential Prototropic Tautomerism in Enzyme-like Nanopocket Created by Single Molecular Break Junction
PA Sreelakshmi, R Mahashaya, S Leitherer, U Rashid, JM Hamill, M Nair, ...
Journal of the American Chemical Society 146 (51), 35242-35251, 2024
2024
Improving single-molecule conductance measurements with change point detection from the econometrics toolbox
JM Hamill, W Bro-Jørgensen, Z Balogh, H Li, S Leitherer, D Solomon, ...
arXiv preprint arXiv:2401.12769, 2024
2024
Simple approach to current-induced effects--bond weakening in metal chains
N Papior, S Leitherer, M Brandbyge
arXiv preprint arXiv:2202.02358, 2022
2022
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