Further Information

Theory Department

Header image 1434030612

Publications

Journal Article (171)

  1. 1.
    Journal Article
    Giménez-Santamarina⁠, S.; Cardona-Serra, S.; Baldovi, J.: Exploring the transport properties of equatorially low-coordinated erbium single ion magnets. Journal of Magnetism and Magnetic Materials 489, 165455 (2019)
  2. 2.
    Journal Article
    Lüders, M.; Cudazzo, P.; Profeta, G.; Continenza, A.; Massidda, S.; Sanna, A.; Gross, E. K. U.: Direct evaluation of the isotope effect within the framework of density functional theory for superconductors. Journal of Physics: Condensed Matter 31 (33), 334001 (2019)
  3. 3.
    Journal Article
    Wang, X.; Ronca, E.; Sentef, M. A.: Cavity quantum electrodynamical Chern insulator: Towards light-induced quantized anomalous Hall effect in graphene. Physical Review B 99 (23), 235156 (2019)
  4. 4.
    Journal Article
    Pellegrini, C.; Glawe, H.; Sanna, A.: Density functional theory of superconductivity in doped tungsten oxides. Physical Review Materials 3 (6) (2019)
  5. 5.
    Journal Article
    Tuovinen, R.; Sentef, M. A.; da Rocha, C. G.; Ferreira, M. S.: Time-resolved impurity-invisibility in graphene nanoribbons. Nanoscale 11 (2019)
  6. 6.
    Journal Article
    Sato, S.; McIver, J. W.; Nuske, M.; Tang, P.; Jotzu, G.; Schulte, B.; Hübener, H.; de Giovannini, U.; Mathey, L.; Sentef, M. A. et al.; Cavalleri, A.; Rubio, A.: Microscopic theory for the light-induced anomalous Hall effect in graphene. Physical Review B 99 (21), 214302 (2019)
  7. 7.
    Journal Article
    Claassen, M.; Kennes, D. M.; Zingl, M.; Sentef, M. A.; Rubio, A.: Universal Optical Control of Chiral Superconductors and Majorana Modes. Nature Physics ? (?) (2019)
  8. 8.
    Journal Article
    Giesbertz, K. J. H.; Ruggenthaler, M.: One-body reduced density-matrix functional theory in finite basis sets at elevated temperatures. Physics Reports: Review Section of Physics Letters 806, pp. 1 - 47 (2019)
  9. 9.
    Journal Article
    Miyamoto, Y.; Zhang, H.; Cheng, X.; Rubio, A.: Ab initio simulation of laser-induced water decomposition close to carbon nanotubes. Physical Review B 99 (16), 165424 (2019)
  10. 10.
    Journal Article
    Gebhardt, J.; Rappe, A. M.: Big data approach for effective ionic radii. Computer Physics Communications 237, pp. 238 - 243 (2019)
  11. 11.
    Journal Article
    Reinhard, T.; Mordovina, U.; Hubig, C.; Kretchmer, J. S.; Schollwöck, U.; Appel, H.; Sentef, M. A.; Rubio, A.: Density-matrix embedding theory study of the one-dimensional Hubbard-Holstein model. Journal of Chemical Theory and Computation 15 (4), pp. 2221 - 2232 (2019)
  12. 12.
    Journal Article
    Klemke, N.; Tancogne-Dejean, N.; Rossi, G. M.; Yang, Y.; Scheiba, F.; Mainz, R. E.; Di Sciacca, G.; Rubio, A.; Kärtner, F. X.; Mücke, O. D.: Polarization-state-resolved high-harmonic spectroscopy of solids. Nature Communications 10 (2019)
  13. 13.
    Journal Article
    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 116 (11), pp. 4883 - 4892 (2019)
  14. 14.
    Journal Article
    Duncan, D. A.; Aguilar, P. C.; Paszkiewicz, M.; Diller, K.; Bondino, F.; Magnano, E.; Klappenberger, F.; Píš, I.; Rubio, A.; Barth, J. V. et al.; Pérez Paz, A.; Allegretti, F.: Local adsorption structure and bonding of porphine on Cu(111) before and after self-metalation. The Journal of Chemical Physics 150 (9), 094702 (2019)
  15. 15.
    Journal Article
    Uemoto, M.; Kuwabara, Y.; Sato, S.; Yabana, K.: Nonlinear polarization evolution using time-dependent density functional theory. The Journal of Chemical Physics 150 (9), 094101 (2019)
  16. 16.
    Journal Article
    Lebedeva, I. V.; Strubbe, D. A.; Tokatly, I. V.; Rubio, A.: Orbital magneto-optical response of periodic insulators from first principles. npj Computational Materials 5 (2019)
  17. 17.
    Journal Article
    Shin, D.; Sato, S.; Hübener, H.; de Giovannini, U.; Kim, J.; Park, N.; Rubio, A.: Unraveling materials Berry curvature and Chern numbers from real-time evolution of Bloch states. Proceedings of the National Academy of Sciences of the United States of America 116 (10), pp. 4135 - 4140 (2019)
  18. 18.
    Journal Article
    Albareda Piquer, G.; Kelly, A.; Rubio, A.: Nonadiabatic quantum dynamics without potential energy surfaces. Physical Review Materials 3 (2), 023803 (2019)
  19. 19.
    Journal Article
    Otobe, T.; Shinohara, Y.; Sato, S.; Yabana, K.: Theory for Electron Excitation in Dielectrics under an Intense Linear and Circularly Polarized Laser Fields. Journal of the Physical Society of Japan 88 (2), 024706 (2019)
  20. 20.
    Journal Article
    Cort, L.; Nielsen, S. E. B.; van Leeuwen, R.: Strictly-correlated-electron approach to excitation energies of dissociating molecules. Physical Review A 99 (2), 022501 (2019)
 
loading content
Go to Editor View