Publications: Foundations of Time-dependent Density Functional Theory


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These papers are ordered by article relevance.

Exact exchange-correlation potential of effectively interacting Kohn-Sham systems
Shunsuke A. Sato, Angel Rubio
Physical Review A 101, 012510 (2020)
Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems
Nicolas Tancogne-Dejean, Micael J. T. Oliveira, Xavier Andrade, Heiko Appel, Carlos H. Borca, Guillaume Le Breton, Florian Buchholz, Alberto Castro, Stefano Corni, Alfredo A. Correa, Umberto De Giovannini, Alain Delgado, Florian G. Eich, Johannes Flick, Gabriel Gil, Adrián Gomez, Nicole Helbig, Hannes Hübener, René Jestädt, Joaquim Jornet-Somoza, Ask H. Larsen, Irina V. Lebedeva, Martin Lüders, Miguel A. L. Marques, Sebastian T. Ohlmann, Silvio Pipolo, Markus Rampp, Carlo A. Rozzi, David A. Strubbe, Shunsuke A. Sato, Christian Schäfer, Iris Theophilou, Alicia Welden, Angel Rubio
Journal of Chemical Physics 152, 124119 (2020)
Relevance of the quadratic diamagnetic and self-polarization terms in cavity quantum electrodynamics
Christian Schäfer, Michael Ruggenthaler, Vasil Rokaj, Angel Rubio
ACS Photonics 7, 4, 975 - 990 (2020)
High-Harmonic generation from spin-polarised defects in solids
Mrudul M. S., Nicolas Tancogne-Dejean, Angel Rubio, Gopal Dixit
npj Quantum Materials 6, (2020)
Effect of Many Modes on Self-Polarization and Photochemical Suppression in Cavities
Norah M. Hoffmann, Lionel Lacombe, Angel Rubio, Neepa T. Maitra
(submitted), (2020)
Light-matter hybrid-orbital-based first-principles methods: the influence of the polariton statistics
Florian Buchholz, Iris Theophilou, Klaas J. H. Giesbertz, Michael Ruggenthaler, Angel Rubio
(submitted), (2020)
Parameter-free hybrid functional based on an extended Hubbard model: DFT+U+V
Nicolas Tancogne-Dejean, Angel Rubio
(submitted), (2020)
Berry Curvature Engineering by Gating Two-Dimensional Antiferromagnets
Shiqiao Du, Peizhe Tang, Jiaheng Li, Zuzhang Lin, Yong Xu, Wenhui Duan, Angel Rubio
Physical Review Research 2, 022025(R) (2020)
Attosecond timing of the dynamical Franz-Keldysh effect"
M. Lucchini,S.A. Sato,F. Schlaepfer,K. Yabana,L. Gallmann,A. Rubio, U. Keller
Journal of Physics Photonics Volume 2, Number 2, (2020)
Exchange-correlation potentials for multi-orbital quantum dots subject to generic density-density interactions and Hund’s rule coupling
Nahual Sobrino, Stefan Kurth, David Jacob
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)