Journal Article (65)

2019
Journal Article
Time-resolved impurity-invisibility in graphene nanoribbons
R. Tuovinen, M. A. Sentef, C. G. da Rocha, M. S. Ferreira
Nanoscale 11, 12296–12304 (2019)
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Journal Article
Adiabatic Preparation of a Correlated Symmetry‐Broken Initial State with the Generalized Kadanoff–Baym Ansatz
R. Tuovinen, D. Golež, M. Schüler, P. Werner, M. Eckstein, M. A. Sentef
Physica Status Solidi B 256 (7), 1800469 (2019)
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post-print
Journal Article
Cavity quantum electrodynamical Chern insulator: Towards light-induced quantized anomalous Hall effect in graphene
X. Wang, E. Ronca, M. A. Sentef
Physical Review B 99 (23), 235156 (2019)
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Journal Article
Density functional theory of superconductivity in doped tungsten oxides
C. Pellegrini, H. Glawe, A. Sanna
Physical Review Materials 3 (6), 064804 (2019)
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Revising the common understanding of metamagnetism in the molecule-based bisdithiazolyl BDTMe compound
C. Climent, S. Vela, J. Jornet-Somoza, M. Deumal
Physical Chemistry Chemical Physics 21 (23), 12184–12191 (2019)
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Journal Article
Cavity Control of Excitons in Two-Dimensional Materials
S. Latini, E. Ronca, U. de Giovannini, H. Hübener, A. Rubio
Nano Letters 19 (6), 3473–3479 (2019)
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Journal Article
Real-Time Propagation TDDFT and Density Analysis for Exciton Coupling Calculations in Large Systems
J. Jornet-Somoza, I. Lebedeva
Journal of Chemical Theory and Computation 15 (6), 3743–3754 (2019)
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Journal Article
Capturing vacuum fluctuations and photon correlations in cavity quantum electrodynamics with multitrajectory Ehrenfest dynamics
N. Hoffmann, C. Schäfer, A. Rubio, A. Kelly, H. Appel
Physical Review A 99 (6), 063819 (2019)
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Microscopic theory for the light-induced anomalous Hall effect in graphene
S. Sato, J. W. McIver, M. Nuske, P. Tang, G. Jotzu, B. Schulte, H. Hübener, U. de Giovannini, L. Mathey, M. A. Sentef, A. Cavalleri, A. Rubio
Physical Review B 99 (21), 214302 (2019)
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Journal Article
One-body reduced density-matrix functional theory in finite basis sets at elevated temperatures
K. J. H. Giesbertz, M. Ruggenthaler
Physics Reports: Review Section of Physics Letters 806, 1–47 (2019)
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post-print
Journal Article
Ab initio simulation of laser-induced water decomposition close to carbon nanotubes
Y. Miyamoto, H. Zhang, X. Cheng, A. Rubio
Physical Review B 99 (16), 165424 (2019)
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Journal Article
Big data approach for effective ionic radii
J. Gebhardt, A. M. Rappe
Computer Physics Communications 237, 238–243 (2019)
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pre-print
Journal Article
Density-matrix embedding theory study of the one-dimensional Hubbard-Holstein model
T. Reinhard, U. Mordovina, C. Hubig, J. S. Kretchmer, U. Schollwöck, H. Appel, M. A. Sentef, A. Rubio
Journal of Chemical Theory and Computation 15 (4), 2221–2232 (2019)
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Journal Article
Polarization-state-resolved high-harmonic spectroscopy of solids
N. Klemke, N. Tancogne-Dejean, G. M. Rossi, Y. Yang, F. Scheiba, R. E. Mainz, G. Di Sciacca, A. Rubio, F. X. Kärtner, O. D. Mücke
Nature Communications 10, 1319 (2019)
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Journal Article
Modification of excitation and charge transfer in cavity quantum-electrodynamical chemistry
C. Schäfer, M. Ruggenthaler, H. Appel, A. Rubio
Proceedings of the National Academy of Sciences of the United States of America 116 (11), 4883–4892 (2019)
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Journal Article
Local adsorption structure and bonding of porphine on Cu(111) before and after self-metalation
D. A. Duncan, P. C. Aguilar, M. Paszkiewicz, K. Diller, F. Bondino, E. Magnano, F. Klappenberger, I. Píš, A. Rubio, J. V. Barth, A. Pérez Paz, F. Allegretti
The Journal of Chemical Physics 150 (9), 094702 (2019)
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Journal Article
Nonlinear polarization evolution using time-dependent density functional theory
M. Uemoto, Y. Kuwabara, S. Sato, K. Yabana
The Journal of Chemical Physics 150 (9), 094101 (2019)
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Journal Article
Orbital magneto-optical response of periodic insulators from first principles
I. V. Lebedeva, D. A. Strubbe, I. V. Tokatly, A. Rubio
Npj Computational Materials 5, 32 (2019)
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Journal Article
Unraveling materials Berry curvature and Chern numbers from real-time evolution of Bloch states
D. Shin, S. Sato, H. Hübener, U. de Giovannini, J. Kim, N. Park, A. Rubio
Proceedings of the National Academy of Sciences of the United States of America 116 (10), 4135–4140 (2019)
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Journal Article
Nonadiabatic quantum dynamics without potential energy surfaces
G. Albareda Piquer, A. Kelly, A. Rubio
Physical Review Materials 3 (2), 023803 (2019)
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