Publications of Patrick Rinke

Li, J.; Wang, Q.; He, G.; Widom, M.; Nemec, L.; Blum, V.; Kim, M.; Rinke, P.; Feenstra, R. M.: Formation of graphene atop a Si adlayer on the C-face of SiC. Physical Review Materials 3 (8), 084006 (2019)

Specht, J. F.; Verdenhalven, E.; Bieniek, B.; Rinke, P.; Knorr, A.; Richter, M.: Theory of Excitation Transfer between Two-Dimensional Semiconductor and Molecular Layers. Physical Review Applied 9 (4), 044025 (2018)

Shang, H.; Carbogno, C.; Rinke, P.; Scheffler, M.: Lattice dynamics calculations based on density-functional perturbation theory in real space. Computer Physics Communications 215, pp. 26 - 46 (2017)

Hofmann, O. T.; Rinke, P.: Band Bending Engineering at Organic/Inorganic Interfaces Using Organic Self-Assembled Monolayers. Advanced Electronic Materials 3 (6), 1600373 (2017)

Zhang, I. Y.; Rinke, P.; Perdew, J. P.; Scheffler, M.: Towards Efficient Orbital-Dependent Density Functionals for Weak and Strong Correlation. Physical Review Letters 117 (13), 133002 (2016)

Atalla, V.; Zhang, I. Y.; Hofmann, O. T.; Ren, X.; Rinke, P.; Scheffler, M.: Enforcing the linear behavior of the total energy with hybrid functionals: Implications for charge transfer, interaction energies, and the random-phase approximation. Physical Review B 94 (3), 035140 (2016)

Zhang, I. Y.; Rinke, P.; Scheffler, M.: Wave-function inspired density functional applied to the H₂/H₂⁺ challenge. New Journal of Physics 18 (7), 073026 (2016)

Chibani, W.; Ren, X.; Scheffler, M.; Rinke, P.: Self-consistent Green's function embedding for advanced electronic structure methods based on a dynamical mean-field concept. Physical Review B 93 (16), 165106 (2016)

Casadei, M.; Ren, X.; Rinke, P.; Rubio, A.; Scheffler, M.: Density functional theory study of the α−γ phase transition in cerium: Role of electron correlation and f-orbital localization. Physical Review B 93 (7), 075153 (2016)

van Setten, M. J.; Caruso, F.; Sharifzadeh, S.; Ren, X.; Scheffler, M.; Liu, F.; Lischner, J.; Lin, L.; Deslippe, J. R.; Louie, S. G. et al.; Yang, C.; Weigend, F.; Neaton, J. B.; Evers, F.; Rinke, P.: GW100: Benchmarking G₀W₀ for Molecular Systems. Journal of Chemical Theory and Computation 11 (12), pp. 5665 - 5687 (2015)

Pinheiro, M.; Caldas, M. J.; Rinke, P.; Blum, V.; Scheffler, M.: Length dependence of ionization potentials of transacetylenes: Internally consistent DFT/GW approach. Physical Review B 92 (19), 195134 (2015)

Ihrig, A.; Wieferink, J.; Zhang, I. Y.; Ropo, M.; Ren, X.; Rinke, P.; Scheffler, M.; Blum, V.: Accurate localized resolution of identity approach for linear-scaling hybrid density functionals and for many-body perturbation theory. New Journal of Physics 17 (9), 093020 (2015)

Ren, X.; Marom, N.; Caruso, F.; Scheffler, M.; Rinke, P.: Beyond the GW approximation: A second-order screened exchange correction. Physical Review B 92 (8), 081104(R) (2015)

Levchenko, S. V.; Ren, X.; Wieferink, J.; Rinke, P.; Blum, V.; Scheffler, M.; Johanni, R.: Hybrid functionals for large periodic systems in an all-electron, numeric atom-centered basis framework. Computer Physics Communications 192, pp. 60 - 69 (2015)

Deinert, J.-C.; Hofmann, O. T.; Meyer, M.; Rinke, P.; Stähler, J.: Local aspects of hydrogen-induced metallization of the ZnO(101¯0) surface. Physical Review B 91 (23), 235313 (2015)

Hofmann, O. T.; Rinke, P.; Scheffler, M.; Heimel, G.: Integer versus Fractional Charge Transfer at Metal(/Insulator)/Organic Interfaces: Cu(/NaCl)/TCNE. ACS Nano 9 (5), pp. 5391 - 5404 (2015)

Sezen, H.; Shang, H.; Bebensee, F.; Yang, C.; Buchholz, M.; Nefedov, A.; Heissler, S.; Carbogno, C.; Scheffler, M.; Rinke, P. et al.; Wöll, C.: Evidence for photogenerated intermediate hole polarons in ZnO. Nature Communications 6 (4), 6901 (2015)

Nemec, L.; Lazarevic, F.; Rinke, P.; Scheffler, M.; Blum, V.: Why graphene growth is very different on the C face than on the Si face of SiC: Insights from surface equilibria and the (3×3)−3C−SiC(1¯1¯1¯) reconstruction. Physical Review B 91 (16), 161408(R) (2015)

Hellgren, M.; Caruso, F.; Rohr, D. R.; Ren, X.; Rubio, A.; Scheffler, M.; Rinke, P.: Static correlation and electron localization in molecular dimers from the self-consistent RPA and GW approximation. Physical Review B 91 (16), 165110 (2015)

Bieniek, B.; Hofmann, O. T.; Rinke, P.: Influence of hydrogen on the structure and stability of ultra-thin ZnO on metal substrates. Applied Physics Letters 106 (13), 131602 (2015)