Direct observation of electron–phonon coupling and slow vibrational relaxation in organic–inorganic hybrid perovskites DB Straus, S Hurtado Parra, N Iotov, J Gebhardt, AM Rappe, JE Subotnik, ...
Journal of the American Chemical Society 138 (42), 13798-13801, 2016
250 2016 Hierarchical on-surface synthesis and electronic structure of carbonyl-functionalized one-and two-dimensional covalent nanoarchitectures C Steiner, J Gebhardt, M Ammon, Z Yang, A Heidenreich, N Hammer, ...
Nature Communications 8, 14765, 2017
150 2017 Growth and electronic structure of boron-doped graphene J Gebhardt, RJ Koch, W Zhao, O Höfert, K Gotterbarm, S Mammadov, ...
Physical Review B 87 (15), 155437, 2013
137 2013 Growth and electronic structure of nitrogen-doped graphene on Ni (111) RJ Koch, M Weser, W Zhao, F Viñes, K Gotterbarm, SM Kozlov, O Höfert, ...
Physical Review B 86 (7), 075401, 2012
94 2012 [2,2′]Paracyclophane-Based π -Conjugated Molecular Wires Reveal Molecular-Junction Behavior A Molina-Ontoria, M Wielopolski, J Gebhardt, A Gouloumis, T Clark, ...
Journal of the American Chemical Society 133 (8), 2370-2373, 2011
83 2011 Reversible hydrogenation of graphene on Ni (111)—synthesis of “graphone” W Zhao, J Gebhardt, F Späth, K Gotterbarm, C Gleichweit, HP Steinrück, ...
Chemistry-A European Journal 21 (8), 3347-3358, 2015
69 2015 Large-area epitaxial growth of curvature-stabilized ABC trilayer graphene Z Gao, S Wang, J Berry, Q Zhang, J Gebhardt, WM Parkin, J Avila, H Yi, ...
Nature Communications 11 (1), 1-10, 2020
60 2020 Doping of J Gebhardt, AM Rappe
Physical Review B 98 (12), 125202, 2018
58 2018 Influence of the Dimensionality and Organic Cation on Crystal and Electronic Structure of Organometallic Halide Perovskites J Gebhardt, Y Kim, AM Rappe
The Journal of Physical Chemistry C 121 (12), 6569-6574, 2017
53 2017 Two-dimensional delocalized states in organometallic bis-acetylide networks on Ag (111) Z Yang, J Gebhardt, TA Schaub, T Sander, J Schönamsgruber, H Soni, ...
Nanoscale 10 (8), 3769-3776, 2018
49 2018 Mix and Match: Organic and Inorganic Ions in the Perovskite Lattice J Gebhardt, AM Rappe
Advanced Materials, 1802697, 2018
42 2018 Influence of the surface dipole layer and Pauli repulsion on band energies and doping in graphene adsorbed on metal surfaces J Gebhardt, F Viñes, A Görling
Physical Review B 86 (19), 195431, 2012
38 2012 Hydrogenation and hydrogen intercalation of hexagonal boron nitride on Ni (1 1 1): reactivity and electronic structure F Späth, J Gebhardt, F Düll, U Bauer, P Bachmann, C Gleichweit, ...
2D Materials 4 (3), 035026, 2017
36 2017 Adding to the Perovskite Universe: Inverse-Hybrid Perovskites J Gebhardt, AM Rappe
ACS Energy Letters 2, 2681-2685, 2017
30 2017 Screened van der Waals correction to density functional theory for solids J Tao, F Zheng, J Gebhardt, JP Perdew, AM Rappe
Physical Review Materials 1 (2), 020802, 2017
30 2017 On‐Surface Assembly of Hydrogen‐and Halogen‐Bonded Supramolecular Graphyne‐Like Networks Z Yang, L Fromm, T Sander, J Gebhardt, TA Schaub, A Görling, M Kivala, ...
Angewandte Chemie International Edition 59 (24), 9549-9555, 2020
29 2020 Hydrogen storage on metal oxide model clusters using density-functional methods and reliable van der Waals corrections J Gebhardt, F Viñes, P Bleiziffer, W Hieringer, A Görling
Physical Chemistry Chemical Physics 16 (11), 5382-5392, 2014
25 2014 Metalated Graphyne-Based Networks as Two-Dimensional Materials: Crystallization, Topological Defects, Delocalized Electronic States, and Site-Specific Doping Z Yang, T Sander, J Gebhardt, TA Schaub, J Schönamsgruber, HR Soni, ...
ACS nano, 2020
21 2020 The contact of graphene with Ni (111) surface: description by modern dispersive forces approaches H Muñoz-Galán, F Viñes, J Gebhardt, A Görling, F Illas
Theoretical Chemistry Accounts 135 (7), 1-9, 2016
20 2016 Gold intercalation of boron-doped graphene on Ni (111): XPS and DFT study W Zhao, J Gebhardt, K Gotterbarm, O Höfert, C Gleichweit, C Papp, ...
Journal of Physics: Condensed Matter 25 (44), 445002, 2013
19 2013 