Publications: Foundations of Time-dependent Density Functional Theory

Years

These papers are ordered by article relevance.

Attosecond screening dynamics mediated by electron-localization in transition metals
M. Volkov, S. A. Sato, F. Schlaepfer, L. Kasmi, N. Hartmann, M. Lucchini, L. Gallmann, A. Rubio, U. Keller
Nature Physics 15, 1145 - 1149 (2019)
Modification of excitation and charge transfer in cavity quantum-electrodynamical chemistry
Christian Schäfer, Michael Ruggenthaler, Heiko Appel, Angel Rubio
Proceedings Of The National Academy Of Sciences Of The United States Of America 116 (11), 4883 - 4892 (2019)
Density-Matrix Embedding Theory Study of the One-Dimensional Hubbard–Holstein Model
Teresa E. Reinhard,Uliana Mordovina,Claudius Hubig,Joshua S. Kretchmer,Ulrich Schollwöck,Heiko Appel,Michael A. Sentef, Angel Rubio
Journal Of Chemical Theory And Computation 15 (4), 2221 - 2232 (2019)
Light-induced anomalous Hall effect in massless Dirac fermion systems and topological insulators with dissipation
S. A. Sato,P. Tang, M. A.Sentef,U. De Giovannini,H. Hubener, A. Rubio
New Journal Of Physics 21, 093005 (2019)
Ab initio simulation of laser-induced water decomposition close to carbon nanotubes
Yoshiyuki Miyamoto, Hong Zhang, Xinlu Cheng, Angel Rubio
Physical Review B 99, 165424 (2019)
Steady-state density functional theory for thermoelectric effects
Nahual Sobrino, Roberto D’Agosta, Stefan Kurth
Physical Review B 100, 195142 (2019)
Capturing Vacuum Fluctuations and Photon Correlations in Cavity QED with Multi-Trajectory Ehrenfest Dynamics
Norah M. Hoffmann,Christian Scháfer,Angel Rubio,Aaron Kelly, Heiko Appel
Physical Review A 99, 063819 (2019)
Benchmarking Semiclassical and Perturbative Methods for Real-time Simulations of Cavity-Bound Emission and Interference
Norah M. Hoffmann, Christian Schäfer, Niko Säkkinen, Angel Rubio, Heiko Appel, Aaron Kelly
Journal of Chemical Physics 151, 244113 (2019)
Optimal control theory for quantum electrodynamics: an initial state problem
Alberto Castro,Heiko Appel, Angel Rubio
European Physical Journal B 92:223 (2019)
Reduced Density-Matrix Approach to Strong Matter-Photon Interaction
F. Buchholz,I. Theophilou,S. E. B. Nielsen,M.Ruggenthaler, A.Rubio
ACS Photonics 6,11, 2697 - 2711 (2019)
Light-Matter Response Functions in Quantum-Electrodynamical Density-Functional Theory: Modi cations of Spectra and of the Maxwell Equations
Johannes Flick,Davis M. Welakuh,Michael Ruggenthaler,Heiko Appel, Angel Rubio
ACS Photonics (2019)
Orbital magneto-optical response of periodic insulators from first principles
Irina V. Lebedeva, David A. Strubbe, Ilya V. Tokatly, Angel Rubio
Computational Materials 5, 32 (2019)