Congress, Workshops and Schools - 2015
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-Program
-Group IV two-dimensional materials: Novel electronic and structural properties. A. Rubio (Contributed talk)
-Kohn-Sham Approach to Cavity Quantum Electrodynamics (Abstract) J. Flick,C. Schafer,C. Pellegrini, H. Appel, M. Ruggenthaler, I.V. Tokatly and A. Rubio
-Time-Evolution of Tensor Networks in Quantum Electrodynamics (Abstract) T. Reinhard, W. Bender, H. Appel and A. Rubio
-Real-time propagation of coupled light-matter systems (Abstract) U. Mordovina, R. Jestadt, H. Appel and A.Rubio
- First-principles nanoplasmonics on metal-clusters dimers (contributed talk). Alejandro Varas, Pablo García-González, F. J. García-Vidal, and Angel Rubio
Chemistry, Materials and Light 2015, in the framework of the International Year of Light IYL2015, Consiglio
Nazionale delle Ricerche (CNR), Bologna, Italy, 21-23 September 2015.
-Steady-state density functional theory for finite-bias conductances. (invited talk) S. Kurth
-Untangling Excitation Energy Transfer for the LHC-II complex from Full First-Principles Calculations.
(Contributed talk) Joaquim Jornet-Somoza, Joseba Alberdi-Rodríguez, Bruce Milne, Xavier Andrade,
Miguel A. L. Marques, Fernando Nogueira, Micael J. T. Oliveira, Angel Rubio.
-Exact Maps in Density Functional Theory for a Lattice model. (Poster) T. Dimitrov, H. Appel and A. Rubio
-Kohn-Sham Approach to Cavity QED: Exact vs. Approximate Effective Fields. J.Flick, C.Pellegrini, M. Ruggenthaler, H. Appel, I.V.Tokatly and A. Rubio
- Time-Evolution of Tensor Networks in Quantum Electro-dynamics.(Poster) T. Reinhard, H. Appel and A. Rubio
- Imaging single-molecule reaction intermediates stabilized by surface dissipation and entropy. (Poster) A. Riss, A. Pérez Paz, S. Wickenburg, H.Z. Tsai, D. G. de Oteyza, A. J. Bradley, M. M. Ugeda, P. Gorman, H. S. Jung, M. F. Crommie, A. Rubio, and F. R. Fischer.
- Wave- packet dynamics in lattice quantum electrodynamics.U. Mordovina, H.Appel and A.Rubio
- Real-time propagation of coupled Maxwell-Kohn-Sham systems. R. Jestaedt,H.Appel, and A.Rubio
- The NoMaD Laboratory and Big-Data Analytics: Extracting hidden information from repositories of computational materials science. F. Mohamed, L.M. Ghiringhelli, C. Carbogno, C.Draxl, A.De Vita, D. Frenkel, F.Illas,R.Nieminen, A. Rubio, K.Sommer Thygesen, and M. Scheffler
-Generalized Pauli constraints: do they have an effect on Reduced Density Matrix Functional Theory minimization?.I.Theophilou, N. Lathiotakis and N. Helbig
-Time-dependent density functional theory of magneto-optical response of periodic insulators. I.V. Lebedeva, I.V. Tokatly and A.Rubio
-Optimized Effective Potential for Quantum Electrodynamical Time-Dependent Density Functional Theory. C. Pellegrini, J.Flick, I.V. Tokatly, H. Appel and A. Rubio
-Krieger-Li-Iafrate approximation to the optimized effective potential approach in density functional theory for quantum electrodynamics. C. Schäfer, J. Flick, H. Appel, C.Pellegrini and A.Rubio
-Spin Hall and Edelstein effects in metallic films: From two to three dimensions (Poster). J. Borge, C.Gorini, G.Vignale, R.Raimondi
-Linear-response formalism in density-functional theory for quantum electrodynamics.N.Hoffmann, H.Appel and A.Rubio
-Optimal thermoelectric figure of merit of SiGe core-shell nanowires. K.Yang, A.Cantarero, A. Rubio and Roberto D’Agosta
-Thermoelectric properties of two- and one-dimensional silicene and germanene from first-principle calculations.K.Yang, A.Cantarero, A. Rubio and Roberto D’Agosta
-Dynamical correction of thermoelectric coefficients for strongly interacting electrons in the Coulomb blockade regime. K.Yang, G.Stefanucci, Stefan Kurth and R. D'Agosta
-The atomic and electronic structure of silicene and germanene on substrates.S. Cahangirov, L.Xian and A.Rubio
-Adiabatic and nonadiabatic molecular dynamics with conditional wave functions.G. Albareda,A. Abedi, J. M. Bofilla, I.Tavernellie and A. Rubio
-Photoinduced Absorption within SWNT Systems.L. N. Glanzmann, D. J. Mowbray, and A. Rubio
-Pilot Applications of the SCE Functional for the Description of Strong Correlation in Adiabatic TDDFTA. A.Mirtschink, U. De Giovannini, A. Rubio and P. Gori-Giorgi[poster link]
- Introduction to Green functions, the GW approximation, and the Bethe-Salpeter equation (invited talk) S. Kurth
- Engineering Photophenomena in Self-assembled 3d Van Der Waals Heterostructures.M.Bala Murali Krishna, M. Man, S. VinoD, C. Chin, T. Harada, J. Taha-Tijerina, C. Sekhar Tiwary, P. Nguyen, P. Chang, A. Rubio, P. Ajayan, Saikat Talapatra, K. Dani
- A new2D -material with high potential for nano.electronics.M.E. Dávila , L.Xian, S.Cahangirov, A. Rubio and G. Le Lay
-Exiton in P3HT/SWNT/PCBM Heterojunctions (poster), L. N. Glanzmann, D. J. Mowbray, and A. Rubio
-Application of compressed sensing to quantum chemistry. Poster presented by Alejandro Pérez Paz.
- Krieger-Li-Iafrate approximation to the optimized effective potential approachin density functional theory for quantum electrodynamics. (Póster). C. Schafer, J.Flick, H.Appel, C.Pellegrini and A.Rubio
-Multi-scale modelling of photoexciton dynamics in medium-large systems (presentation), L. N. Glanzmann, D. J. Mowbray, and A. Rubio
- Local versus global electronic properties of chalcopyrite alloys. R.Sarmiento-Pérez,S.Botti, C.S. Schnohr, I.Lauermann, A.Rubio adn B.Johnson
- Quantum electrodynamical time-dependent density-functional theory on a lattice. Mehdi Farzanehpour, I. V. Tokatly (Abstract)
- Modelling charge transfer in Polymer/PCBM/SWNT hybrid systems. Livia N. Glanzmann, Duncan J. Mowbray, Angel Rubio (Presentation)
- Electron and spin transport through hybrid organic-inorganic interfaces and in molecular devices: insights from first-principles and model calculations. A. Droghetti
- First-principles nanoplasmonics on metal-clusters dimers (Póster). Alejandro Varas, Pu Zhang, Johannes Feist, Pablo García-González, F. J. García-Vidal, and Angel Rubio
- Correlated Light-Matter Interactions in Cavity QED. J.Flick, H. Appel and A.Rubio
Density matrix perturbation theory for magneto-optical response of periodic insulators. I.V. Lebedeva, I.V. Tokatly and A.Rubio
-First principles calculations of insulator-to-metal transition in photoexcited monoclinic VO2. L. Xian, M. Gatti, P. Cudazzo, D. Wegkamp, M. Herzog, C.L. McGahan, R.E. Marvel, R.F. Haglund, Jr., M. Wolf, J. Stähler, and A. Rubio
-Laser induced electron diffraction in aligned molecules.F.Krecinic, F.Brauße, A. Rouzee, U. DeGiovannini, Q. Zheng, A. Rubio and M. Vrakking
-Optimized Effective Potential for QED-(TD)DFT. C. Pellegrini, J. Flick, I. V. Tokatly, H. Appel and A. Rubio.
-Magneto-optical response of periodic insulators. I.V. Lebedeva, I.V. Tokatly and A. Rubio