Van der Waals interactions between organic adsorbates and at organic/inorganic interfaces A Tkatchenko, L Romaner, OT Hofmann, E Zojer, C Ambrosch-Draxl, ... MRS bulletin 35 (6), 435-442, 2010 | 331 | 2010 |
Benchmark of methods for azabenzenes N Marom, F Caruso, X Ren, OT Hofmann, T Körzdörfer, JR Chelikowsky, ... Physical Review B—Condensed Matter and Materials Physics 86 (24), 245127, 2012 | 211 | 2012 |
Understanding chemical versus electrostatic shifts in X-ray photoelectron spectra of organic self-assembled monolayers TC Taucher, I Hehn, OT Hofmann, M Zharnikov, E Zojer The Journal of Physical Chemistry C 120 (6), 3428-3437, 2016 | 153 | 2016 |
F4TCNQ on Cu, Ag, and Au as prototypical example for a strong organic acceptor on coinage metals GM Rangger, OT Hofmann, L Romaner, G Heimel, B Bröker, RP Blum, ... Physical Review B—Condensed Matter and Materials Physics 79 (16), 165306, 2009 | 147 | 2009 |
The impact of dipolar layers on the electronic properties of organic/inorganic hybrid interfaces E Zojer, TC Taucher, OT Hofmann Advanced Materials Interfaces 6 (14), 1900581, 2019 | 145 | 2019 |
Controlling the work function of ZnO and the energy-level alignment at the interface to organic semiconductors with a molecular electron acceptor R Schlesinger, Y Xu, OT Hofmann, S Winkler, J Frisch, J Niederhausen, ... Physical Review B—Condensed Matter and Materials Physics 87 (15), 155311, 2013 | 144 | 2013 |
Advances in density-functional calculations for materials modeling RJ Maurer, C Freysoldt, AM Reilly, JG Brandenburg, OT Hofmann, ... Annual Review of Materials Research 49 (1), 1-30, 2019 | 119 | 2019 |
Large work function reduction by adsorption of a molecule with a negative electron affinity: Pyridine on ZnO(101¯) OT Hofmann, JC Deinert, Y Xu, P Rinke, J Stähler, M Wolf, M Scheffler The Journal of chemical physics 139 (17), 2013 | 96 | 2013 |
Gold work function reduction by 2.2 eV with an air-stable molecular donor layer B Bröker, RP Blum, J Frisch, A Vollmer, OT Hofmann, R Rieger, K Müllen, ... Applied physics letters 93 (24), 2008 | 94 | 2008 |
Space-charge transfer in hybrid inorganic-organic systems Y Xu, OT Hofmann, R Schlesinger, S Winkler, J Frisch, J Niederhausen, ... Physical review letters 111 (22), 226802, 2013 | 91 | 2013 |
Work-function modification beyond pinning: when do molecular dipoles count? OT Hofmann, DA Egger, E Zojer Nano letters 10 (11), 4369-4374, 2010 | 90 | 2010 |
Tunable phosphorescent NIR oxygen indicators based on mixed benzo-and naphthoporphyrin complexes F Niedermair, SM Borisov, G Zenkl, OT Hofmann, H Weber, R Saf, ... Inorganic chemistry 49 (20), 9333-9342, 2010 | 77 | 2010 |
Integer versus Fractional Charge Transfer at Metal(/Insulator)/Organic Interfaces: Cu(/NaCl)/TCNE OT Hofmann, P Rinke, M Scheffler, G Heimel ACS nano 9 (5), 5391-5404, 2015 | 74 | 2015 |
Interface dipoles of organic molecules on Ag (111) in hybrid density-functional theory OT Hofmann, V Atalla, N Moll, P Rinke, M Scheffler New Journal of Physics 15 (12), 123028, 2013 | 73 | 2013 |
Density-dependent reorientation and rehybridization of chemisorbed conjugated molecules for controlling interface electronic structure B Bröker, OT Hofmann, GM Rangger, P Frank, RP Blum, R Rieger, ... Physical review letters 104 (24), 246805, 2010 | 73 | 2010 |
Enforcing the linear behavior of the total energy with hybrid functionals: Implications for charge transfer, interaction energies, and the random-phase approximation V Atalla, IY Zhang, OT Hofmann, X Ren, P Rinke, M Scheffler Physical Review B 94 (3), 035140, 2016 | 67 | 2016 |
Electronic properties of organic-based interfaces L Kronik, N Koch MRS bulletin 35 (6), 417-421, 2010 | 65 | 2010 |
“Soft” Metallic Contact to Isolated C60 Molecules H Glowatzki, B Bröker, RP Blum, OT Hofmann, A Vollmer, R Rieger, ... Nano Letters 8 (11), 3825-3829, 2008 | 63 | 2008 |
Understanding the electronic structure of metal/SAM/Organic− semiconductor heterojunctions F Rissner, GM Rangger, OT Hofmann, AM Track, G Heimel, E Zojer ACS nano 3 (11), 3513-3520, 2009 | 59 | 2009 |
Orientational Ordering of Nonplanar Phthalocyanines on Cu (111): Strength<? format?> and Orientation of the Electric Dipole Moment A Gerlach, T Hosokai, S Duhm, S Kera, OT Hofmann, E Zojer, ... Physical Review Letters 106 (15), 156102, 2011 | 58 | 2011 |