Publications

Journal Article

Dynamics of electronic states in the insulating intermediate surface phase of 1T−TaS₂

J. Dong, W. Qi, D. Shin, L. Cario, Z. Chen, R. Grasset, D. Boschetto, M. Weis, P. Lample, E. Pastor, T. Ritschel, M. Marsi, A. Taleb, N. Park, A. Rubio, E. Papalazarou, L. Perfetti

Physical Review B 108 (15), 155145 (2023)

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Journal Article

RKKY interaction in one-dimensional flat-band lattices

K. Laubscher, C. S. Weber, M. Hünenberger, H. Schoeller, D. M. Kennes, D. Loss, J. Klinovaja

Physical Review B 108 (15), 155429 (2023)

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Journal Article

Understanding Polaritonic Chemistry from Ab Initio Quantum Electrodynamics

M. Ruggenthaler, D. Sidler, A. Rubio

Chemical Reviews 123 (19), 11191–11229 (2023)

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Journal Article

Optoelectronic Manifestation of Orbital Angular Momentum Driven by Chiral Hopping in Helical Se Chains

B. Kim, D. Shin, S. Namgung, N. Park, K.-W. Kim, J. Kim

ACS Nano 17 (19), 18873–18882 (2023)

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Journal Article

Mapping the electronic transitions of protonation sites in peptides using soft X-ray action spectroscopy

J. Leroux, A. Kotobi, K. Hirsch, T. Lau, C. Ortiz-Mahecha, D. Maksimov, R. Meißner, B. Oostenrijk, M. Rossi, K. Schubert, M. Timm, F. Trinter, I. Unger, V. Zamudio-Bayer, L. Schwob, S. Bari

Physical Chemistry Chemical Physics 25 (37), 25603–25618 (2023)

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Journal Article

Photon pumping, photodissociation and dissipation at interplay for the fluorescence of a molecule in a cavity

M. Gopalakrishna, E. Viñas Boström, C. Verdozzi

SciPost Physics 15 (4), 138 (2023)

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Journal Article

Emergence of superconductivity in single-crystalline LaFeAsO under simultaneous Sm and P substitution

N. D. Zhigadlo, R. Puzniak, P. J. W. Moll, F. Bernardini, T. Shiroka

Journal of Alloys and Compounds 958, 170384 (2023)

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Journal Article

Evolution of superconducting diodes

P. J. W. Moll, V. B. Geshkenbein

Nature Physics 19 (10), 1379–1380 (2023)

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Journal Article

An ultra-low field SQUID magnetometer for measuring antiferromagnetic and weakly remanent magnetic materials at low temperatures

M. Paulsen, J. Lindner, B. Klemke, J. Beyer, M. Fechner, D. Meier, K. Kiefer

Review of Scientific Instruments 94 (10), 103904 (2023)

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Journal Article

Water layer and radiation damage effects on the orientation recovery of proteins in single-particle imaging at an X-ray free-electron laser

J. E, M. Stransky, Z. Shen, Z. Jurek, C. Fortmann‑Grote, R. Bean, R. Santra, B. Ziaja, A. P. Mancus

Scientific Reports 13 (1), 16359 (2023)

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Journal Article

High-harmonic generation in liquids with few-cycle pulses: effect of laser-pulse duration on the cut-off energy

A. Mondal, B. Waser, T. Balciunas, O. Neufeld, Z. Yin, N. Tancogne-Dejean, A. Rubio, H. J. Wörner

Optics Express 31 (21), 34348–34361 (2023)

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Journal Article

Molecular van der Waals Fluids in Cavity Quantum Electrodynamics

J. P. Philbin, T. S. Haugland, T. K. Ghosh, E. Ronca, M. Chen, P. Narang, H. Koch

The Journal of Physical Chemistry Letters 14 (40), 8988–8993 (2023)

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Journal Article

Polaritonic Probe of an Emergent 2D Dipole Interface

D. J. Rizzo, J. Zhang, B. S. Jessen, F. L. Ruta, M. Cothrine, J. Yan, D. G. Mandrus, S. E. Nagler, T. Taniguchi, K. Watanabe, M. M. Fogler, A. N. Pasupathy, A. J. Millis, A. Rubio, J. C. Hone, C. R. Dean, D. N. Basov

Nano Letters 23 (18), 8426–8435 (2023)

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Journal Article

Frequency-resolved Microscopic Current Density Analysis of Linear and Nonlinear Optical Phenomena in Solids

S. Sato

Journal of the Physical Society of Japan 92 (9), 094401 (2023)

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Journal Article

Phenomenology of bond and flux orders in kagome metals

G. Wagner, C. Guo, P. J. W. Moll, T. Neupert, M. H. Fischer

Physical Review B 108 (12), 125136 (2023)

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Journal Article

Floquet Engineering of Black Phosphorus upon Below-Gap Pumping

S. Zhou, C. Bao, B. Fan, F. Wang, H. Zhong, H. Zhang, P. Tang, W. Duan, S. Zhou

Physical Review Letters 131 (11), 116401 (2023)

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Journal Article

Shared metadata for data-centric materials science

L. M. Ghiringhelli, C. Baldauf, T. Bereau, S. Brockhauser, C. Carbogno, J. Chamanara, S. Cozzini, S. Curtarolo, C. Draxl, S. Dwaraknath, Á. Fekete, J. Kermode, C. T. Koch, M. Kühbach, A. N. Ladines, P. Lambrix, M.-O. Himmer, S. V. Levchenko, M. J. T. Oliveira, A. Michalchuk, R. E. Miller, B. Onat, P. Pavone, G. Pizzi, B. Regler, G.-M. Rignanese, J. Schaarschmidt, M. Scheidgen, A. Schneidewind, T. Sheveleva, C. Su, D. Usvyat, O. Valsson, C. Wöll, M. Scheffler

Scientific Data 10 (1), 626 (2023)

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Journal Article

Switching the Moiré Lattice Models in the Twisted Bilayer WSe₂ by Strain or Pressure

Y. Gao, Q. Xu, M. U. Farooq, L. D. Xian, L. Huang

Nano Letters 23 (17), 7921–7926 (2023)

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Journal Article

Fast Lithium Ion Transport Pathways Constructed by Two-Dimensional Boron Nitride Nanoflakes in Quasi-Solid-State Polymer Electrolyte

J. Zuo, Y. Dang, P. Zhai, B. Li, L. Wang, M. Wang, Z. Yang, Q. Chen, X. Gu, Z. Li, P. Tang, Y. Gong

Nano Letters 23 (17), 8106–8114 (2023)

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Journal Article

An anisotropic van der Waals dielectric for symmetry engineering in functionalized heterointerfaces

Z. Li, J. Huang, L. Zhou, Z. Xu, F. Qin, P. Chen, X. Sun, G. Liu, C. Sui, C. Qiu, Y. Lu, H. Gou, X. Xi, T. Ideue, P. Tang, Y. Iwasa, H. Yuan

Nature Communications 14 (1), 5568 (2023)

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Journal Article

Cavity-renormalized quantum criticality in a honeycomb bilayer antiferromagnet

L. Weber, E. Viñas Boström, M. Claassen, A. Rubio, D. M. Kennes

Communications Physics 6 (1), 247 (2023)

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Journal Article

Time-resolved plasmon-assisted generation of optical-vortex pulses

E. I. Albar, F. Bonafé, V. Kosheleva, S. T. Ohlmann, H. Appel, A. Rubio

Scientific Reports 13 (1), 14748 (2023)

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Journal Article

Cavity Born–Oppenheimer Hartree–Fock Ansatz: Light–Matter Properties of Strongly Coupled Molecular Ensembles

T. Schnappinger, D. Sidler, M. Ruggenthaler, A. Rubio, M. Kowalewski

The Journal of Physical Chemistry Letters 14 (36), 8024–8033 (2023)

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Journal Article

Spin-Flip Unitary Coupled Cluster Method: Toward Accurate Description of Strong Electron Correlation on Quantum Computers

F. Pavošević, I. Tavernelli, A. Rubio

The Journal of Physical Chemistry Letters 14 (35), 7876–7882 (2023)

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Journal Article

Band Nonlinearity-Enabled Manipulation of Dirac Nodes, Weyl Cones, and Valleytronics with Intense Linearly Polarized Light

O. Neufeld, H. Hübener, G. Jotzu, U. de Giovannini, A. Rubio

Nano Letters 23 (16), 7568–7575 (2023)

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Journal Article

Light-Induced Metastable Hidden Skyrmion Phase in the Mott Insulator Cu₂OSeO₃

B. Truc, A. A. Sapozhnik, P. Tengdin, E. Viñas Boström, T. Schönenberger, S. Gargiulo, I. Madan, T. LaGrange, A. Magrez, C. Verdozzi, A. Rubio, H. M. Rønnow, F. Carbone

Advanced Materials 35 (33), 2304197 (2023)

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Journal Article

Optically induced avoided crossing in graphene

S. Buchenau, B. Grimm-Lebsanft, F. Biebl, T. Glier, L. Westphal, J. Reichstetter, D. Manske, M. Fechner, A. Cavalleri, S. Herres-Pawlis, M. Rübhausen

Physical Review B 108 (7), 075419 (2023)

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Journal Article

The Structure of the Density-Potential Mapping. Part II: Including Magnetic Fields

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

ACS Physical Chemistry Au 3 (6), 492–511 (2023)

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Journal Article

Roadmap on electronic structure codes in the exascale era

V. Gavini, S. Baroni, V. Blum, D. R. Bowler, A. Buccheri, J. R. Chelikowsky, S. Das, W. Dawson, P. Delugas, M. Dogan, C. Draxl, G. Galli, L. Genovese, P. Giannozzi, M. Giantomassi, X. Gonze, M. Govoni, A. Gulans, F. Gygi, J. M. Herbert, S. Kokott, T. D. Kühne, K.-H. Liou, T. Miyazaki, P. Motamarri, A. Nakata, J. E. Pask, C. Plessl, L. E. Ratcliff, R. M. Richard, M. Rossi, R. Schade, M. Scheffler, O. Schütt, P. Suryanarayana, M. Torrent, L. Truflandier, T. L. Windus, Q. Xu, V. W.-Z. Yu, D. Perez

Modelling and Simulation in Materials Science and Engineering 31 (6), 063301 (2023)

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Journal Article

Simple extension of the plane-wave final state in photoemission: Bringing understanding to the photon-energy dependence of two-dimensional materials

C. S. Kern, A. Haags, L. Egger, X. Yang, H. Kirschner, S. Wolff, T. Seyller, A. Gottwald, M. Richter, U. de Giovannini, A. Rubio, M. G. Ramsey, F. C. Bocquet, S. Soubatch, F. S. Tautz, P. Puschnig, S. Moser

Physical Review Research 5 (3), 033075 (2023)

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Journal Article

First-Principles Simulations of Tip Enhanced Raman Scattering Reveal Active Role of Substrate on High-Resolution Images

Y. Litman, F. Bonafé, A. Akkoush, H. Appel, M. Rossi

The Journal of Physical Chemistry Letters 14 (30), 6850–6859 (2023)

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Journal Article

Are There Universal Signatures of Topological Phases in High-Harmonic Generation? Probably Not.

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

Physical Review X 13 (3), 031011 (2023)

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Journal Article

Optimizing Floquet engineering for non-equilibrium steady states with gradient-based methods

A. Castro, S. Sato

SciPost Physics 15 (1), 029 (2023)

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Journal Article

Electronic-Structure Properties from Atom-Centered Predictions of the Electron Density

A. Grisafi, A. Lewis, M. Rossi, M. Ceriotti

Journal of Chemical Theory and Computation 19 (14), 4335–4780 (2023)

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Journal Article

Can Neural Quantum States Learn Volume-Law Ground States?

G. Passetti, D. Hofmann, P. Neitemeier, L. Grunwald, M. A. Sentef, D. M. Kennes

Physical Review Letters 131 (3), 036502 (2023)

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Journal Article

Ab initio spatial phase retrieval via intensity triple correlations

N. Peard, K. Ayyer, H. N. Chapman

Optics Express 31 (15), 25082–25092 (2023)

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Journal Article

Cavity Light-Matter Entanglement through Quantum Fluctuations

G. Passetti, C. Eckhardt, M. A. Sentef, D. M. Kennes

Physical Review Letters 131 (2), 023601 (2023)

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Journal Article

Electronic dispersion, correlations and stacking in the photoexcited state of 1T-TaS₂

J. Dong, D. Shin, E. Pastor, T. Ritschel, L. Cario, Z. Chen, W. Qi, R. Grasset, M. Marsi, A. Taleb-Ibrahimi, N. Park, A. Rubio, L. Perfetti, E. Papalazarou

2D Materials 10 (4), 045001 (2023)

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Journal Article

Nonequilibrium correlation dynamics in the one-dimensional Fermi-Hubbard model: A testbed for the two-particle reduced density matrix theory

S. Donsa, F. Lackner, J. Burgdörfer, M. Bonitz, B. Kloss, A. Rubio, I. Březinová

Physical Review Research 5 (3), 033022 (2023)

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Journal Article

Time-Resolved Single-Particle X-ray Scattering Reveals Electron-Density Gradients As Coherent Plasmonic-Nanoparticle-Oscillation Source

D. Hoeing, R. Salzwedel, L. Worbs, Y. Zhuang, A. K. Samanta, J. Lübke, A. Estillore, K. Dlugolecki, C. Passow, B. Erk, N. Ekanayaje, D. Ramm, J. Correa, C. C. Papadooulou, A. T. Noor, F. Schulz, M. Selig, A. Knorr, K. Ayyer, J. Küpper, H. Lange

Nano Letters 23 (13), 5943–5950 (2023)

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