Publications of Angel Rubio

Riss, A.; Richter, M.; Paz, A. P.; Wang, X.-Y.; Rajesh, R.; He, Y.; Ducke, J.; Corral, E.; Wuttke, M.; Seufert, K. et al.; Garnica, M.; Rubio, A.; Barth, J. V.; Narita, A.; Müllen, K.; Müllen, K.; Berger, R. F. J.; Feng, X.; Palma, C.-A.; Auwärter, W.: Polycyclic aromatic chains on metals and insulating layers by repetitive [3+2] cycloadditions. Nature Communications 11 (1), 1490 (2020)

Rubio, A.: Pressure induced phase transition in correlated oxides and simple metals: Mott and charge-transfer insulators. Journal of Physics: Conference Series 950, 032003 (2017)

Lubasch, M.; Fuks, J. I.; Appel, H.; Rubio, A.; Cirac, J. I.; Bañuls, M.-C.: Systematic construction of density functionals based on matrix product state computations. New Journal of Physics 18 (8), 083039 (2016)

Dimitrov, T.; Appel, H.; Fuks, J. I.; Rubio, A.: Exact maps in density functional theory for lattice models. New Journal of Physics 18 (8), 083004 (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)

Flick, J.; Ruggenthaler, M.; Appel, H.; Rubio, A.: Kohn–Sham approach to quantum electrodynamical density-functional theory: Exact time-dependent effective potentials in real space. Proceedings of the National Academy of Sciences of the USA 112 (50), pp. 15285 - 15290 (2015)

Pellegrini, C.; Flick, J.; Tokatly, I. V.; Appel, H.; Rubio, A.: Optimized Effective Potential for Quantum Electrodynamical Time-Dependent Density Functional Theory. Physical Review Letters 115 (9), 093001 (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)

Malic, E.; Appel, H.; Hofmann, O. T.; Rubio, A.: Energy transfer in porphyrin-functionalized graphene. Physica Status Solidi B 251 (12), pp. 2495 - 2498 (2014)

Wegkamp, D.; Herzog, M.; Xian, L.; Gatti, M.; Cudazzo, P.; McGahan, C. L.; Marvel, R. E.; Haglund, R. F.; Rubio, A.; Wolf, M. et al.; Stähler, J.: Instantaneous Band Gap Collapse in Photoexcited Monoclinic VO₂ due to Photocarrier Doping. Physical Review Letters 113 (21), 216401 (2014)

Cudazzo, P.; Gatti, M.; Rubio, A.: Interplay between structure and electronic properties of layered transition-metal dichalcogenides: Comparing the loss function of 1T and 2H polymorphs. Physical Review B 90 (20), 205128 (2014)

Dávila, M. E.; Xian, L.; Cahangirov, S.; Rubio, A.; Le Lay, G.: Germanene: a novel two-dimensional germanium allotrope akin to graphene and silicene. New Journal of Physics 16 (9), 095002 (2014)

Sarmiento-Pérez, R.; Botti, S.; Schnohr, C. S.; Lauermann, I.; Rubio, A.; Johnson, B.: Local versus global electronic properties of chalcopyrite alloys: X-ray absorption spectroscopy and ab initio calculations. Journal of Applied Physics 116 (9), 093703 (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)

Albareda Piquer, G.; Appel, H.; Franco, I.; Abedi, A.; Rubio, A.: Correlated Electron-Nuclear Dynamics with Conditional Wave Functions. Physical Review Letters 113 (8), 083003 (2014)

Ruggenthaler, M.; Flick, J.; Pellegrini, C.; Appel, H.; Tokatly, I. V.; Rubio, A.: Quantum-electrodynamical density-functional theory: Bridging quantum optics and electronic-structure theory. Physical Review A 90 (1), 012508 (2014)

Falke, S. M.; Rozzi, C. A.; Brida, D.; Maiuri, M.; Amato, M.; Sommer, E.; Sio, A. D.; Rubio, A.; Cerullo, G.; Molinari, E. et al.; Lienau, C.: Coherent ultrafast charge transfer in an organic photovoltaic blend. Science 344 (6187), pp. 1001 - 1005 (2014)

Malic, E.; Appel, H.; Hofmann, O. T.; Rubio, A.: Förster-Induced Energy Transfer in Functionalized Graphene. The Journal of Physical Chemistry C 118 (17), pp. 9283 - 9289 (2014)

Flick, J.; Appel, H.; Rubio, A.: Nonadiabatic and Time-Resolved Photoelectron Spectroscopy for Molecular Systems. Journal of Chemical Theory and Computation 10 (4), pp. 1665 - 1676 (2014)

Squire, R. H.; March, N. H.; Rubio, A.: Are there really cooper pairs and persistent currents in aromatic molecules? International Journal of Quantum Chemistry 114 (7), pp. 437 - 440 (2014)