Publications of Patrick Rinke

Sforzini, J.; Nemec, L.; Denig, T.; Stadtmüller, B.; Lee, T.-L.; Kumpf, C.; Soubatch, S.; Starke, U.; Rinke, P.; Blum, V. et al.; Bocquet, F. .; Tautz, F. .: Approaching Truly Freestanding Graphene: The Structure of Hydrogen-Intercalated Graphene on 6H-SiC(0001). Physical Review Letters 114 (10), 106804 (2015)

Sinai, O.; Hofmann, O. T.; Rinke, P.; Scheffler, M.; Heimel, G.; Kronik, L.: Multiscale approach to the electronic structure of doped semiconductor surfaces. Physical Review B 91 (7), 075311 (2015)

Yan, Q.; Rinke, P.; Janotti, A.; Scheffler, M.; Van de Walle, C. G.: Effects of strain on the band structure of group-III nitrides. Physical Review B 90 (12), 125118 (2014)

Caruso, F.; Atalla, V.; Ren, X.; Rubio, A.; Scheffler, M.; Rinke, P.: First-principles description of charge transfer in donor-acceptor compounds from self-consistent many-body perturbation theory. Physical Review B 90 (8), 085141 (2014)

Verdenhalven, E.; Knorr, A.; Richter, M.; Bieniek, B.; Rinke, P.: Theory of optical excitations in dipole-coupled hybrid molecule-semiconductor layers: Coupling of a molecular resonance to semiconductor continuum states. Physical Review B 89 (23), 235314 (2014)

Hofmann, O. T.; Atalla, V.; Moll, N.; Rinke, P.; Scheffler, M.: Interface dipoles of organic molecules on Ag(111) in hybrid density-functional theory. New Journal of Physics 15 (12), 123028 (2013)

Zhang, I. Y.; Ren, X.; Rinke, P.; Blum, V.; Scheffler, M.: Numeric atom-centered-orbital basis sets with valence-correlation consistency from H to Ar. New Journal of Physics 15 (12), 123033 (2013)

Xu, Y.; Hofmann, O. T.; Schlesinger, R.; Winkler, S.; Frisch, J.; Niederhausen, J.; Vollmer, A.; Blumstengel, S.; Henneberger, F.; Koch, N. et al.; Rinke, P.; Scheffler, M.: Space-Charge Transfer in Hybrid Inorganic-Organic Systems. Physical Review Letters 111 (22), 226802 (2013)

Hofmann, O. T.; Deinert, J.-C.; Xu, Y.; Rinke, P.; Stähler, J.; Wolf, M.; Scheffler, M.: Large work function reduction by adsorption of a molecule with a negative electron affinity: Pyridine on ZnO(10¯10). The Journal of Chemical Physics 139 (17), 174701 (2013)

Stähler, J.; Hofmann, O. T.; Rinke, P.; Blumstengel, S.; Henneberger, F.; Li, Y.; Heinz, T. F.: Raman study of 2,7-bis(biphenyl-4-yl-)2',7'-ditertbutyl-9,9'-spirobifluorene adsorbed on oxide surfaces. Chemical Physics Letters 584, pp. 74 - 78 (2013)

Nemec, L.; Blum, V.; Rinke, P.; Scheffler, M.: Thermodynamic equilibrium conditions of graphene films on SiC. Physical Review Letters 111 (6), 065502 (2013)

Caruso, F.; Rinke, P.; Ren, X.; Rubio, A.; Scheffler, M.: Self-consistent GW: an all-electron implementation with localized basis functions. Physical Review B 88 (7), 075105 (2013)

Moll, N.; Xu, Y.; Hofmann, O. T.; Rinke, P.: Stabilization of semiconductor surfaces through bulk dopants. New Journal of Physics 15 (8), 083009 (2013)

Ren, X.; Rinke, P.; Scuseria, G. E.; Scheffler, M.: Renormalized second-order perturbation theory for the electron correlation energy: Concept, implementation, and benchmarks. Physical Review B 88 (3), 035120 (2013)

Schlesinger, R.; Xu, Y.; Hofmann, O. T.; Winkler, S.; Frisch, J.; Niederhausen, J.; Vollmer, A.; Blumstengel, S.; Henneberger, F.; Rinke, P. et al.; Scheffler, M.; Koch, N.: Controlling the work function of ZnO and the energy-level alignment at the interface to organic semiconductors with a molecular electron acceptor. Physical Review B 87 (15), 155311 (2013)

Caruso, F.; Rohr, D.; Hellgren, M.; Ren, X.; Rinke, P.; Rubio, A.; Scheffler, M.: Bond Breaking and Bond Formation: How Electron Correlation is Captured in Many-Body Perturbation Theory and Density-Functional Theory. Physical Review Letters 110 (14), 146403 (2013)

Schleife, A.; Rinke, P.; Bechstedt, F.; Van de Walle, C. G.: Enhanced Optical Absorption Due to Symmetry Breaking in TiO_2(1−x)S_2x Alloys. The Journal of Physical Chemistry C 117 (8), pp. 4189 - 4193 (2013)

Marom, N.; Caruso, F.; Ren, X.; Hofmann, O. T.; Körzdörfer, T.; Chelikowsky, J. R.; Rubio, A.; Scheffler, M.; Rinke, P.: Benchmark of GW methods for azabenzenes. Physical Review B 86 (24), 245127 (2012)

Casadei, M.; Ren, X.; Rinke, P.; Rubio, A.; Scheffler, M.: Density-Functional Theory for f-Electron Systems: The α-γ Phase Transition in Cerium. Physical Review Letters 109 (14), 146402 (2012)

Caruso, F.; Rinke, P.; Ren, X.; Scheffler, M.; Rubio, A.: Unified description of ground and excited states of finite systems: The self-consistent GW approach. Physical Review B 86 (8), 081102(R) (2012)