Publikationen

Zeitschriftenartikel

Quantum Embedding Method for the Simulation of Strongly Correlated Systems on Quantum Computers

M. Rossmannek, F. Pavošević, A. Rubio, I. Tavernelli

The Journal of Physical Chemistry Letters 14 (14), 3491–3497 (2023)

MPG.PuRe

Zeitschriftenartikel

Nematically Templated Vortex Lattices in Superconducting FeSe

S. Y. Song, C. Hua, L. Bell, W. Ko, H. Fangohr, J. Yan, G. B. Halász, E. F. Dumitrescu, B. J. Lawrie, P. Maksymovych

Nano Letters 23 (7), 2822–2830 (2023)

MPG.PuRe

Zeitschriftenartikel

Ultrafast electron localization and screening in a transition metal dichalcogenide

Z. Schumacher, S. Sato, S. Neb, A. Niedermayr, L. Gallmann, A. Rubio, U. Keller

Proceedings of the National Academy of Sciences of the United States of America 120 (15), e2221725120 (2023)

MPG.PuRe

Zeitschriftenartikel

Topological Floquet engineering using two frequencies in two dimensions

Y. Wang, A.-S. Walter, G. Jotzu, K. Viebahn

Physical Review A 107 (4), 043309 (2023)

MPG.PuRe

Zeitschriftenartikel

The Structure of Density-Potential Mapping. Part I: Standard Density-Functional Theory

M. Penz, E. I. Tellgren, M. A. Csirik, M. Ruggenthaler, A. Laestadius

ACS Physical Chemistry Au 3 (4), 334–337 (2023)

MPG.PuRe

Zeitschriftenartikel

Electronic Descriptors for Supervised Spectroscopic Predictions

C. M. de Armas-Morejón, L. A. Montero-Cabrera, A. Rubio, J. Jornet-Somoza

Journal of Chemical Theory and Computation 19 (6), 1818–1826 (2023)

MPG.PuRe

Zeitschriftenartikel

Dynamics of photoinduced ferromagnetism in oxides with orbital degeneracy

J. B. Curtis, A. Disa, M. Fechner, A. Cavalleri, P. Narang

Physical Review Research 5 (1), 013204 (2023)

MPG.PuRe

Zeitschriftenartikel

Attosecond magnetization dynamics in non-magnetic materials driven by intense femtosecond lasers

O. Neufeld, N. Tancogne-Dejean, U. de Giovannini, H. Hübener, A. Rubio

npj Computational Materials 9 (1), 39 (2023)

MPG.PuRe

Zeitschriftenartikel

Rashba spin-orbit coupling in the square-lattice Hubbard model: A truncated-unity functional renormalization group study

J. Beyer, J. Hauck, L. Klebl, T. Schwemmer, D. M. Kennes, R. Thomale, C. Honerkamp, S. Rachel

Physical Review B 107 (12), 125115 (2023)

MPG.PuRe

Zeitschriftenartikel

New perspectives in time-resolved laser-induced electron diffraction

U. de Giovannini, J. Küpper, A. Trabattoni

Journal of Physics B: Atomic, Molecular and Optical Physics 56 (5), 054002 (2023)

MPG.PuRe

Zeitschriftenartikel

Eliminating Artificial Boundary Conditions in Time-Dependent Density Functional Theory Using Fourier Contour Deformation

J. Kaye, A. Barnett, L. Greengard, U. de Giovannini, A. Rubio

Journal of Chemical Theory and Computation 19 (5), 1409–1420 (2023)

MPG.PuRe

Zeitschriftenartikel

Witnessing Nonequilibrium Entanglement Dynamics in a Strongly Correlated Fermionic Chain

D. R. Baykusheva, M. Kalthoff, D. Hofmann, M. Claassen, D. M. Kennes, M. A. Sentef, M. Mitrano

Physical Review Letters 130 (10), 106902 (2023)

MPG.PuRe

Zeitschriftenartikel

Photoinduced Dynamics at the Water/TiO2(101) Interface

M. Wagstaffe, A. Dominguez-Castro, L. Wenthaus, S. Palutke, D. Kutnyakhov, M. Heber, F. Pressacco, S. Dziarzhytski, H. Gleißner, V. K. Gupta, H. Redlin, A. Dominguez, T. Frauenheim, A. Rubio, A. Stierle, H. Noei

Physical Review Letters 130 (10), 108001 (2023)

MPG.PuRe

Zeitschriftenartikel

Ab initio study of water dissociation on a charged Pd(111) surface

K. Fidanyan, G. Liu, M. Rossi

The Journal of Chemical Physics 158 (9), 094707 (2023)

MPG.PuRe

Zeitschriftenartikel

Reconstructing the infrared spectrum of a peptide from representative conformers of the full canonical ensemble

A. Kotobi, L. Schwob, G. B. Vonbun-Feldbauer, M. Rossi, P. Gasparotto, C. Feiler, G. Berden, J. Oomens, B. Oostenrijk, D. Scuderi, S. Bari, R. H. Meißner

Communications Chemistry 6 (1), 46 (2023)

MPG.PuRe

Zeitschriftenartikel

Water dopant control of structural stability and charge recombination of perovskite solar cells: A first-principles study

J. Fu, M. Li, Y. Kang, K. Yang, H. Li, J. Zhang, W. Ma

Applied Surface Science 612, 155794 (2023)

MPG.PuRe

Zeitschriftenartikel

Photon-shot-noise-limited transient absorption soft X-ray spectroscopy at the European XFEL

L. L. Guyader, A. Eschenlohr, M. Beye, W. Schlotter, F. Döring, C. Carinan, D. Hickin, N. Agarwal, C. Boeglin, U. Bovensiepen, J. Buck, R. Carley, A. Castoldi, A. D'Elia, J.-T. Delitz, W. Ehsan, R. Engel, F. Erdinger, H. Fangohr, P. Fischer, C. Fiorini, A. Föhlisch, L. Gelisio, M. Gensch, N. Gerasimova, R. Gort, K. Hansen, S. Hauf, M. Izquierdo, E. Jal, E. Kamil, S. Karabekyan, T. Kluyver, T. Laarmann, T. Lojewski, D. Lomidze, S. Maffessanti, T. Mamyrbayev, A. Marcelli, L. Mercadier, G. Mercurio, P. S. Miedema, K. Ollefs, K. Rossnagel, B. Rösner, N. Rothenbach, A. Samartsev, J. Schlappa, K. Setoodehnia, G. S. Chiuzbaian, L. Spieker, C. Stamm, F. Stellato, S. Techert, M. Teichmann, M. Turcato, B. Van Kuiken, H. Wende, A. Yaroslavtsev, J. Zhu, S. Molodtsov, C. David, M. Porro, A. Scherz

Journal of Synchrotron Radiation 30 (2), 284–300 (2023)

MPG.PuRe

Zeitschriftenartikel

Competition of density waves and superconductivity in twisted tungsten diselenide

L. Klebl, A. Fischer, L. Classen, M. M. Scherer, D. M. Kennes

Physical Review Research 5 (1), L012034 (2023)

MPG.PuRe

Zeitschriftenartikel

Two-fluid dynamics in driven YBa₂Cu₃O_6.48

A. Ribak, M. Buzzi, D. Nicoletti, R. Singla, Y. Liu, S. Nakata, B. Keimer, A. Cavalleri

Physical Review B 107 (10), 104508 (2023)

MPG.PuRe

Zeitschriftenartikel

Licht treibt Materie an

M. A. Sentef

Physik Journal 3, 51–56 (2023)

MPG.PuRe

Zeitschriftenartikel

Realizing Attosecond Core-Level X-ray Spectroscopy for the Investigation of Condensed Matter Systems

A. M. Summers, S. Severino, M. Reduzzi, T. P. H. Sidiropoulos, D. E. Rivas, N. Di Palo, H.-W. Sun, Y.-H. Chien, I. León, B. Buades, S. L. Cousin, S. M. Teichmann, T. Mey, K. Mann, B. Keitel, E. Plönjes-Palm, D. K. Efetov, H. Schwoerer, J. Biegert

Ultrafast Science 3, 0004 (2023)

MPG.PuRe

Zeitschriftenartikel

Electron correlation effects on the g factor of lithiumlike ions

D. V. Zinenko, D. A. Glazov, V. Kosheleva, A. V. Volotka, S. Fritzsche

Physical Review A 107 (3), 032815 (2023)

MPG.PuRe

Zeitschriftenartikel

Quantum correlation of electron and ion energy in the dissociative strong-field ionization of H₂

A. Geyer, O. Neufeld, D. Trabert, U. de Giovannini, M. Hofmann, N. Anders, L. Sarkadi, M. S. Schöffler, L. P. H. Schmidt, A. Rubio, T. Jahnke, M. Kunitski, S. Eckart

Physical Review Research 5 (1), 013123 (2023)

MPG.PuRe

Zeitschriftenartikel

Probing many-body effects in harmonic traps with twisted light

J. I. Fuks, G. F. Quinteiro Rosen, H. Appel, P. I. Tamborenea

Physical Review B 107 (8), L081111 (2023)

MPG.PuRe

Zeitschriftenartikel

Realization of a three-dimensional quantum Hall effect in a Zeeman-induced second-order topological insulator on a torus

Z. Hou, C. S. Weber, D. M. Kennes, D. Loss, H. Schoeller, J. Klinovaja, M. Pletyukhov

Physical Review B 107 (7), 075437 (2023)

MPG.PuRe

Zeitschriftenartikel

Accurate Relativistic Real-Time Time-Dependent Density Functional Theory for Valence and Core Attosecond Transient Absorption Spectroscopy

T. Moitra, L. Konecny, M. Kadek, A. Rubio, M. Repisky

The Journal of Physical Chemistry Letters 14 (7), 1714–1724 (2023)

MPG.PuRe

Zeitschriftenartikel

Negative refraction in hyperbolic hetero-bicrystals

A. J. Sternbach, S. Moore, A. Rikhter, S. Zhang, R. Jing, Y. Shao, B. Kim, S. Xu, S. Liu, J. H. Edgar, A. Rubio, C. Dean, J. Hone, M. M. Fogler, D. N. Basov

Science 379 (6632), 555–557 (2023)

MPG.PuRe

Zeitschriftenartikel

Exact Two-Component TDDFT with Simple Two-Electron Picture-Change Corrections: X-ray Absorption Spectra Near L- and M-Edges of Four-Component Quality at Two-Component Cost

L. Konecny, S. Komorovsky, J. Vicha, K. Ruud, M. Repisky

The Journal of Physical Chemistry A 127 (5), 1360–1376 (2023)

MPG.PuRe

Zeitschriftenartikel

Time-based Chern number in periodically driven systems in the adiabatic limit

I.-T. Lu, D. Shin, U. de Giovannini, H. Hübener, J. Zhang, S. Latini, A. Rubio

Physical Review Research 5 (1), 013081 (2023)

MPG.PuRe

Zeitschriftenartikel

Pseudospin-selective Floquet band engineering in black phosphorus

S. Zhou, C. Bao, B. Fan, H. Zhou, Q. Gao, H. Zhong, T. Lin, H. Liu, P. Yu, P. Tang, S. Meng, W. Duan, S. Zhou

Nature 614 (7946), 75–80 (2023)

MPG.PuRe

Zeitschriftenartikel

Superconductivity of repulsive spinless fermions with sublattice potentials

Y. He, K. Yang, J. B. Hauck, E. J. Bergholtz, D. M. Kennes

Physical Review Research 5 (1), L012009 (2023)

MPG.PuRe

Zeitschriftenartikel

Optical classification of excitonic phases in molecular functionalized atomically-thin semiconductors

D. Christiansen, M. Selig, M. Rossi, A. Knorr

Physical Review B 107 (4), L041401 (2023)

MPG.PuRe

Zeitschriftenartikel

Passivation of positively charged cationic defects in perovskite with nitrogen-donor crown ether enabling efficient perovskite solar cells

Y. Yang, T. Zhao, M.-H. Li, X. Wu, M. Han, S.-C. Yang, Q. Xu, L. D. Xian, X. Chi, N.-J. Zhao, H. Cui, S. Li, J.-S. Hu, B. Zhang, Y. Jiang

Chemical Engineering Journal 451 (4), 138962 (2023)

MPG.PuRe

Zeitschriftenartikel

Direct Optical Probe of Magnon Topology in Two-Dimensional Quantum Magnets

E. Viñas Boström, T. S. Parvini, J. W. McIver, A. Rubio, S. V. Kusminskiy, M. A. Sentef

Physical Review Letters 130 (2), 026701 (2023)

MPG.PuRe

Zeitschriftenartikel

Multilayered Atomic Relaxation in van der Waals Heterostructures

D. Halbertal, L. Klebl, V. Hsieh, J. Cook, S. Carr, G. Bian, C. Dean, D. M. Kennes, D. N. Basov

Physical Review X 13 (1), 011026 (2023)

MPG.PuRe

Zeitschriftenartikel

Cavity Click Chemistry: Cavity-Catalyzed Azide−Alkyne Cycloaddition

F. Pavosevic, R. L. Smith, A. Rubio

The Journal of Physical Chemistry A 127 (48), 10184–10188 (2023)

MPG.PuRe

Zeitschriftenartikel

Numerically Exact Solution for a Real Polaritonic System under Vibrational Strong Coupling in Thermodynamic Equilibrium: Loss of Light–Matter Entanglement and Enhanced Fluctuations

D. Sidler, M. Ruggenthaler, A. Rubio

Journal of Chemical Theory and Computation 19 (23), 8801–8814 (2023)

MPG.PuRe

Zeitschriftenartikel

Continuous manipulation of magnetic anisotropy in a van der Waals ferromagnet via electrical gating

M. Tang, J. Huang, F. Qin, K. Zhai, T. Ideue, Z. Li, F. Meng, A. Nie, L. Wu, X. Bi, C. Zhang, L. Zhou, P. Chen, C. Qiu, P. Tang, H. Zhang, X. Wan, L. Wang, Z. Liu, Y. Tian, Y. Iwasa, H. Yuan

Nature Electronics 6 (1), 28–36 (2023)

MPG.PuRe

Zeitschriftenartikel

Speckle contrast of interfering fluorescence X-rays

F. Trost, K. Ayyer, D. Oberthuer, O. Yefanov, S. Bajt, C. Caleman, A. Weimer, A. Feld, H. Weller, S. Boutet, J. Koglin, N. Timneanu, J. von Zanthier, R. Röhlsberger, H. N. Chapman

Journal of Synchrotron Radiation 30 (1), 11–23 (2023)

MPG.PuRe

Zeitschriftenartikel

Ultrafast Spin Dynamics and Photoinduced Insulator-to-Metal Transition in α-RuCl₃

J. Zhang, N. Tancogne-Dejean, L. D. Xian, E. Viñas Boström, M. Claassen, D. M. Kennes, A. Rubio

Nano Letters 23 (18), 8712–8718 (2023)

MPG.PuRe

Buchkapitel (3)

2023

Buchkapitel

A New Era of Quantum Materials Mastery and Quantum Simulators In and Out of Equilibrium

D. M. Kennes, A. Rubio

In: R. Citro, M. Lewenstein, A. Rubio, W. P. Schleich, J. D. Wells, G. P. Zank, Herausgeber. Sketches of Physics: The Celebration Collection, Cham: Springer; 2023

MPG.PuRe

Buchkapitel

Sample Preparation for Time-Resolved Serial Crystallography: Practical Considerations

P. Mehrabi, E.-C. Schulz

In: A. Sousa, L. Passarinha, Herausgeber. Advanced Methods in Structural Biology, Berlin/Heidelberg: Springer Science+Business Media; 2023, S. 361–379

MPG.PuRe

Buchkapitel

In-Situ Observation of the Formation of Laser-Induced Periodic Surface Structures with Extreme Spatial and Temporal Resolution

K. Sokolowski-Tinten, J. Bonse, A. Barty, H. N. Chapman, S. Bajt, M. J. Bogan, S. Boutet, A. Cavalleri, S. Düsterer, M. Frank, J. Hajdu, S. Hau-Riege, S. Marchesini, N. Stojanovic, R. Treusch

In: R. Stoian, J. Bonse, Herausgeber. Ultrafast Laser Nanostructuring (Springer Series in Optical Sciences 239), Springer Nature Switzerland AG; 2023, S. 257–276

MPG.PuRe