Advanced capabilities for materials modelling with Quantum ESPRESSO P Giannozzi, O Andreussi, T Brumme, O Bunau, MB Nardelli, M Calandra, ... Journal of physics: Condensed matter 29 (46), 465901, 2017 | 8258 | 2017 |
Visualizing the spin of individual cobalt-phthalocyanine molecules C Iacovita, MV Rastei, BW Heinrich, T Brumme, J Kortus, L Limot, ... Physical review letters 101 (11), 116602, 2008 | 318 | 2008 |
Twist-angle-dependent interlayer exciton diffusion in WS2–WSe2 heterobilayers L Yuan, B Zheng, J Kunstmann, T Brumme, AB Kuc, C Ma, S Deng, ... Nature materials 19 (6), 617-623, 2020 | 308 | 2020 |
First-principles theory of field-effect doping in transition-metal dichalcogenides: Structural properties, electronic structure, Hall coefficient, and electrical conductivity T Brumme, M Calandra, F Mauri Physical Review B 91 (15), 155436, 2015 | 169 | 2015 |
Evidence for flat bands near the Fermi level in epitaxial rhombohedral multilayer graphene D Pierucci, H Sediri, M Hajlaoui, JC Girard, T Brumme, M Calandra, ... ACS nano 9 (5), 5432-5439, 2015 | 151 | 2015 |
Modeling spin transport in helical fields: derivation of an effective low-dimensional Hamiltonian R Gutierrez, E Díaz, C Gaul, T Brumme, F Domínguez-Adame, G Cuniberti The Journal of Physical Chemistry C 117 (43), 22276-22284, 2013 | 148 | 2013 |
Momentum-Resolved View of Electron-Phonon Coupling in Multilayer L Waldecker, R Bertoni, H Hübener, T Brumme, T Vasileiadis, D Zahn, ... Physical Review Letters 119 (3), 036803, 2017 | 125 | 2017 |
Direct observation of the tunneling channels of a chemisorbed molecule BW Heinrich, C Iacovita, T Brumme, DJ Choi, L Limot, MV Rastei, ... The Journal of Physical Chemistry Letters 1 (10), 1517-1523, 2010 | 83 | 2010 |
Coverage-driven electronic decoupling of Fe-phthalocyanine from a Ag (111) substrate TG Gopakumar, T Brumme, J Kroger, C Toher, G Cuniberti, R Berndt The Journal of Physical Chemistry C 115 (24), 12173-12179, 2011 | 82 | 2011 |
Electrochemical doping of few-layer ZrNCl from first principles: Electronic and structural properties in field-effect configuration T Brumme, M Calandra, F Mauri Physical Review B 89 (24), 245406, 2014 | 66 | 2014 |
Stone–Wales Defects Cause High Proton Permeability and Isotope Selectivity of Single‐Layer Graphene Y An, AF Oliveira, T Brumme, A Kuc, T Heine Advanced Materials 32 (37), 2002442, 2020 | 48 | 2020 |
Phosphoric Acid Catalyzed Formation of Hydrogen-Bonded o-Quinone Methides. Enantioselective Cycloaddition with β-Dicarbonyl Compounds toward … F Göricke, S Haseloff, M Laue, M Schneider, T Brumme, C Schneider The Journal of Organic Chemistry 85 (18), 11699-11720, 2020 | 32 | 2020 |
Electron–phonon-driven three-dimensional metallicity in an insulating cuprate E Baldini, MA Sentef, S Acharya, T Brumme, E Sheveleva, F Lyzwa, ... Proceedings of the National Academy of Sciences 117 (12), 6409-6416, 2020 | 31 | 2020 |
Dynamical bistability of single-molecule junctions: A combined experimental and theoretical study of PTCDA on Ag (111) T Brumme, OA Neucheva, C Toher, R Gutiérrez, C Weiss, R Temirov, ... Physical Review B—Condensed Matter and Materials Physics 84 (11), 115449, 2011 | 27 | 2011 |
Atomic and electronic structure of trilayer graphene/SiC (0001): Evidence of Strong Dependence on Stacking Sequence and charge transfer D Pierucci, T Brumme, JC Girard, M Calandra, MG Silly, F Sirotti, ... Scientific Reports 6 (1), 33487, 2016 | 23 | 2016 |
Strong dipolar repulsion of one-dimensional interfacial excitons in monolayer lateral heterojunctions L Yuan, B Zheng, Q Zhao, R Kempt, T Brumme, AB Kuc, C Ma, S Deng, ... ACS nano 17 (16), 15379-15387, 2023 | 22* | 2023 |
Anisotropic strain on phonons in a-plane GaN layers studied by Raman scattering G Irmer, T Brumme, M Herms, T Wernicke, M Kneissl, M Weyers Journal of Materials Science: Materials in Electronics 19, 51-57, 2008 | 18 | 2008 |
Thiol-based defect healing of WSe2 and WS2 A Schwarz, H Alon-Yehezkel, A Levi, RK Yadav, K Majhi, Y Tzuriel, ... npj 2D Materials and Applications 7 (1), 59, 2023 | 12 | 2023 |
Determination of scattering time and of valley occupation in transition-metal dichalcogenides doped by field effect T Brumme, M Calandra, F Mauri Physical Review B 93 (8), 081407, 2016 | 12 | 2016 |
Stacking Polymorphism in PtSe2 Drastically Affects Its Electromechanical Properties R Kempt, S Lukas, O Hartwig, M Prechtl, A Kuc, T Brumme, S Li, ... Advanced Science 9 (22), 2201272, 2022 | 11 | 2022 |