Publikationen

Zeitschriftenartikel

Recent Developments in DFTB+, a Software Package for Efficient Atomistic Quantum Mechanical Simulations

B. Hourahine, M. Berdakin, J. A. Bich, F. Bonafé, C. Camacho, Q. Cui, M. Y. Deshaye, G. Díaz Mirón, S. Ehlert, M. Elstner, T. Frauenheim, N. Goldman, R. A. González León, T. van der Heide, S. Irle, T. Kowalczyk, Kubař T., I. S. Lee, C. R. Lien-Medrano, A. Maryewski, T. Melson, S. K. Min, T. Niehaus, A. M. N. Niklasson, A. Pecchia, K. Reuter, C. G. Sánchez, C. Scheurer, M. A. Sentef, P. V. Stishenko, V. Q. Vuong, B. Aradi

The Journal of Physical Chemistry A 129 (24), 5373–5390 (2025)

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Zeitschriftenartikel

Momentum-resolved fingerprint of Mottness in layer-dimerized Nb₃Br₈

M. Date, F. Petocchi, Y. Yen, J. A. Krieger, B. Pal, V. Hasse, E. C. McFarlane, C. Körner, J. Yoon, M. D. Watson, V. N. Strocov, Y. Xu, I. Kostanovski, M. N. Ali, S. Ju, N. C. Plumb, M. A. Sentef, G. Woltersdorf, M. Schüler, P. Werner, C. Felser, S. S. P. Parkin, N. B. M. Schröter

Nature Communications 16 (1), 4037 (2025)

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Zeitschriftenartikel

Metastable photo-induced superconductivity far above T_c

S. Chattopadhyay, C. Eckhardt, D. M. Kennes, M. A. Sentef, D. Shin, A. Rubio, A. Cavalleri, E. A. Demler, M. Michael

npj Quantum Materials 10 (1), 34 (2025)

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Zeitschriftenartikel

Optical pumping of electronic quantum Hall states with vortex light

D. Session, M. J. Mehrabad, N. Paithanker, T. Grass, C. Eckhardt, B. Cao, D. G. S. Forero, K. Li, M. S. Alam, G. S. Solomon, N. Schine, J. Sau, R. Sordan, M. Hafezi

Nature Photonics 19 (2), 156–161 (2025)

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2024

Zeitschriftenartikel

Non-adiabatic Couplings in Surface Hopping with Tight Binding Density Functional Theory: The Case of Molecular Motors

G. D. Mirón, C. R. Lien-Medrano, D. Banerjee, M. Monti, B. Aradi, M. A. Sentef, T. A. Niehaus, A. Hassanali

Journal of Chemical Theory and Computation 20 (23), 10602–10614 (2024)

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Zeitschriftenartikel

Theories for charge-driven nematicity in kagome metals

F. Grandi, M. A. Sentef, D. M. Kennes, R. Thomale

Physical Review B 110 (24), 245138 (2024)

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Zeitschriftenartikel

Giant chiral magnetoelectric oscillations in a van der Waals multiferroic

F. Y. Gao, X. Peng, X. Cheng, E. Viñas Boström, D. S. Kim, R. K. Jain, D. Vishnu, K. Raju, R. Sankar, S.-F. Lee, M. A. Sentef, T. Kurumaji, X. Li, P. Tang, A. Rubio, E. Baldini

Nature 632 (8024), 273–279 (2024)

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Zeitschriftenartikel

Exploring the Mechanisms behind Non-aromatic Fluorescence with the Density Functional Tight Binding Method

G. D. Mirón, C. R. Lien-Medrano, D. Banerjee, U. N. Morzan, M. A. Sentef, R. Gebauer, A. Hassanali

Journal of Chemical Theory and Computation 20 (9), 3864–3878 (2024)

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Zeitschriftenartikel

Theory of resonantly enhanced photo-induced superconductivity

C. Eckhardt, S. Chattopadhyay, D. M. Kennes, E. A. Demler, M. A. Sentef, M. Michael

Nature Communications 15 (1), 2300 (2024)

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Zeitschriftenartikel

Ab initio electron-lattice downfolding: Potential energy landscapes, anharmonicity, and molecular dynamics in charge density wave materials

A. Schobert, J. Berges, E. G. C. P. van Loon, M. A. Sentef, S. Brener, M. Rossi, T. O. Wehling

SciPost Physics 16, 046 (2024)

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2023

Zeitschriftenartikel

A functional-analysis derivation of the parquet equation

C. Eckhardt, P. Kappl, A. Kauch, K. Held

SciPost Physics 15 (5), 203 (2023)

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Zeitschriftenartikel

Edge and corner skin effects of chirally coupled magnons characterized by a topological winding tuple

C. Cai, D. M. Kennes, M. A. Sentef, T. Yu

Physical Review B 108 (17), 174421 (2023)

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Zeitschriftenartikel

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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Zeitschriftenartikel

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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Zeitschriftenartikel

Build-up and dephasing of Floquet–Bloch bands on subcycle timescales

S. Ito, M. Schüler, M. Meierhofer, S. Schlauderer, J. Freudenstein, J. Reimann, D. Afanasiev, K. A. Kokh, O. E. Tereshchenko, J. Güdde, M. A. Sentef, U. Höfer, R. Huber

Nature 616 (7958), 696–701 (2023)

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Zeitschriftenartikel

Theory of nematic charge orders in kagome metals

F. Grandi, A. Consiglio, M. A. Sentef, R. Thomale, D. M. Kennes

Physical Review B 107 (15), 155131 (2023)

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