Further Information

Theory Department

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Journal Article (149)

  1. 1.
    Noda, M.; Sato, S.; Hirokawa, Y.; Uemoto, M.; Takeuchi, T.; Yamada, S.; Yamada, A.; Shinohara, Y.; Yamaguchi, M.; Iida, K. et al.; Floss, I.; Otobe, T.; Lee, K.-M.; Ishimura, K.; Boku, T.; Bertsch, G. F.; Nobusada, K.; Yabana, K.: SALMON: Scalable Ab-initio Light–Matter simulator for Optics and Nanoscience. Computer Physics Communications 235, pp. 356 - 365 (2019)
  2. 2.
    Schäfer, C.; Ruggenthaler, M.; Appel, H.; Rubio, A.: Modification of excitation and charge transfer in cavity quantum-electrodynamical chemistry. Proceedings of the National Academy of Sciences of the United States of America (2019)
  3. 3.
    Peng, L.; Xian, J.-J.; Tang, P.; Rubio, A.; Zhang, S.-C.; Zhang, W.; Fu, Y.-S.: Visualizing topological edge states of single and double bilayer Bi supported on multibilayer Bi(111) films. Physical Review B 98 (24), 245108 (2018)
  4. 4.
    Coutinho, J. T.; Pereira, C. C. L.; Marçalo, J.; Baldovi, J.; Almeida, M.; Monteiro, B.; Pereira, L. C. J.: Magnetic Study of a Layered Lanthanide Hydroxide family: Ln8(OH)20Cl4•nH2O (Ln = Tb, Ho, Er). Dalton Transactions 47 (45), pp. 16211 - 16217 (2018)
  5. 5.
    Tuovinen, R.; Golež, D.; Schüler, M.; Werner, P.; Eckstein, M.; Sentef, M. A.: Adiabatic Preparation of a Correlated Symmetry‐Broken Initial State with the Generalized Kadanoff–Baym Ansatz. Physica Status Solidi B 255 (11), 1800469 (2018)
  6. 6.
    Sentef, M. A.; Ruggenthaler, M.; Rubio, A.: Cavity quantum-electrodynamical polaritonically enhanced electron-phonon coupling and its influence on superconductivity. Science Advances 4 (11), eaau6969 (2018)
  7. 7.
    Marques, M. A. L.; Nogueira, F.; Rubio, A.; Ullrich, C. A.: Special issue in honor of Eberhard K.U. Gross for his 65th birthday. European Physical Journal B 91 (11), 297 (2018)
  8. 8.
    Cañon-Mancisidor, W.; Miralles, S. G.; Baldovi, J.; Espallargas, G. M.; Gaita-Ariño, A.; Coronado, E.: Sublimable Single Ion Magnets Based on Lanthanoid Quinolinate Complexes: The Role of Intermolecular Interactions on Their Thermal Stability. Inorganic Chemistry 57 (22), pp. 14170 - 14177 (2018)
  9. 9.
    Castells-Gil, J.; Baldovi, J.; Martí-Gastaldo, C.; Espallargas, G. M.: Implementation of slow magnetic relaxation in a SIM-MOF through a structural rearrangement. Dalton Transactions 47, pp. 14734 - 14740 (2018)
  10. 10.
    Coutinho, J. T.; Perfetti, M.; Baldovi, J.; Antunes, M. A.; Hallmen, P. P.; Bamberger, H.; Crassee, I.; Orlita, M.; Almeida, M.; van Slageren, J. et al.; Pereira, L. C. J.: Spectroscopic Determination of the Electronic Structure of a Uranium Single‐Ion Magnet. Chemistry – A European Journal 47, pp. 14734 - 14740 (2018)
  11. 11.
    Fuks, J. I.; Lacombe, L.; Nielsen, S. E. B.; Maitrab, N. T.: Exploring non-adiabatic approximations to the exchange–correlation functional of TDDFT. Physical Chemistry Chemical Physics 20 (41), pp. 26145 - 26160 (2018)
  12. 12.
    Schmidt, P.; Vialla, F.; Latini, S.; Massicotte, M.; Tielrooij, K.-J.; Mastel, S.; Navickaite, G.; Danovich, M.; Ruiz-Tijerina, D. A.; Yelgel, C. et al.; Fal’ko, V.; Thygesen, K. S.; Hillenbrand, R.; Koppens, F. H. L.: Nano-imaging of intersubband transitions in van der Waals quantum wells. Nature Nanotechnology 13 (11), pp. 1035 - 1041 (2018)
  13. 13.
    Le Breton, G.; Rubio, A.; Tancogne-Dejean, N.: High-harmonic generation from few-layer hexagonal boron nitride: Evolution from monolayer to bulk response. Physical Review B 98 (16), 165308 (2018)
  14. 14.
    Laestadius, A.; Penz, M.; Tellgren, E. I.; Ruggenthaler, M.; Kvaal, S.; Helgaker, T.: Generalized Kohn–Sham iteration on Banach spaces. The Journal of Chemical Physics 149 (16), 164103 (2018)
  15. 15.
    Topp, G.; Tancogne-Dejean, N.; Kemper, A. F.; Rubio, A.; Sentef, M. A.: All-optical nonequilibrium pathway to stabilising magnetic Weyl semimetals in pyrochlore iridates. Nature Communications (2018)
  16. 16.
    Covito, F.; Perfetto, E.; Rubio, A.; Stefanucci, G.: Benchmarking Nonequilibrium Green’s Functions against Configuration Interaction for time-dependent Auger decay processes. European Physical Journal B 91 (10), 216 (2018)
  17. 17.
    Krečinić, F.; Wopperer, P.; Frusteri, B.; Brauße, F.; Brisset, J.G.; de Giovannini, U.; Rubio, A.; Rouzée, A.; Vrakking, M. J. J.: Multiple-orbital effects in laser-induced electron diffraction of aligned molecules. Physical Review A 98, 041401(R) (2018)
  18. 18.
    Nielsen, S. E. B.; Ruggenthaler, M.; van Leeuwen, R.: Numerical construction of the density-potential mapping. European Physical Journal B 91 (10), 235 (2018)
  19. 19.
    Penz, M.: Regularity for evolution equations with non-autonomous perturbations in Banach spaces. Journal of Mathematical Physics 59 (10), 103512 (2018)
  20. 20.
    Sato, S.; Hübener, H.; de Giovannini, U.; Rubio, A.: Ab Initio Simulation of Attosecond Transient Absorption Spectroscopy in Two-Dimensional Materials. Applied Sciences 8 (10), 1777 (2018)
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