MPSD-Publikationen

Zeitschriftenartikel

Best practices for cryo-trapping time-resolved crystallography with the Spitrobot crystal plunger

R. Bosman, C. E. Hatton, A. Prester, M. Spilliopolou, V. Apostolopoulou, F. Tellkamp, P. Mehrabi, E.-C. Schulz

Protein Science 35 (10), e70741 (2026)

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2D theoretically twistable material database

Y. Jiang, U. Petralanda, H. Pi, G. Skorupskii, Q. Xu, D. Călugăru, H. Hu, J. Xie, R. A. Mustaf, P. Höhn, V. Haase, A. Ouahchi, S. Samal, J. Zhu, M. G. Vergniory, M. Claassen, D. Yang, Z. Geng, G. Avedissian, Y. Wang, M. G. Vergniory, L. Elcoro, M. Claassen, L. Elcoro, N. Regnault, M. M. Ugeda, J. Shan, K. F. Mak, D. K. Efetov, E. Morosan, D. M. Kennes, A. Rubio, L. D. Xian, C. Felser, L. M. Schoop, B. A. Bernevig

Science 393 (6818) (2026)

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Enhancing measurement precision of non-degenerate two-photon absorption

G. Shukla, S. Panahiyan, D. K. Mishra, F. Schlawin

Quantum Science and Technology 11 (4), 045050 (2026)

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Mechanical Sensing of Metamagnetic Tricriticality in Two-Dimensional CrI₃

F. Liu, T. Luo, X. Wu, J. Xiao, X. J. Xu, S. Jiang, K. F. Mak, J. Shan

Physical Review Letters 137 (11), 116708 (2026)

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Coherent terahertz magnon-phonon three-wave mixing in a layered antiferromagnet

L. Li, N. Wu, Z. Lin, Z. Li, L. Liu, E. Viñas Boström, Y. Wan, X. Wang, J. Luo, F. Liu, A. Rubio, Q. Zhang

Nature Communications 17 (1), 9507 (2026)

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Enhanced third-harmonic response of the PtTe₂ transition metal dichalcogenide

L. Di Mauro Villari, S. Grillo, O. Pulci, S. Macis, S. Lupi, A. Marini

EPL (Europhysics Letters) 155 (6), 65001 (2026)

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Few‐Photon Fluorescence From Ultracold Bosons in an Optical Cavity

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

Contributions to Plasma Physics 66 (7-8), e70151 (2026)

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Attosecond tuning of coherent electron dynamics in doped semiconductors

G. Inzani, A. Eskandari-asl, G. L. Dolso, N. Di Palo, B. Moio, A. Lamperti, A. Molle, G. Isella, J. Frigerio, E. Napolitani, D. De Salvador, R. Borrego-Varillas, M. Nisoli, A. Avella, S. Sato, M. Lucchini

Nature Photonics 20 (9), 1013–1020 (2026)

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Optically induced Faraday–Goldstone waves

D. Kaplan, P. A. Volkov, A. Cavalleri, P. Chandra

Proceedings of the National Academy of Sciences of the United States of America 123 (35), e2535297123 (2026)

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Simple and robust aqueous sheet jets in vacuum

P. E. Konold, A. Ansari, D. Westphal, P. Adams, R. Letrun, J. Valerio, J. Bielecki, R. C. Alvarez, S. Bódizs, K. Dörner, G. Ducrocq, L. Grunewald, K. Kharitonov, C. Kim, M. Kloos, A. Králová, T. Larkiala, M. Maihöfer, D. Manatou, R. Mehlig, D. V. M. Melo, P. Meszaros, L. Monrroy, T. Sato, R. Schubert, P. Smyth, E. Sobolev, F. Trost, R. de Wijn, L. Worbs, T. V. Yenupuri, T. You, J. Schulz, R. Bean, K. Ayyer, M. A. D. Martin, H. Kirst, H. Grubmüller, S. Westenhoff, R. A. Kirian, F. R. N. C. Maia

IUCrJ 13 (5), 659–667 (2026)

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Festkörperphysik: Mehr Strom durch weniger Metall

J. Seo, P. J. W. Moll

Physik in unserer Zeit 57 (5), 200–201 (2026)

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Correlated electrons extend X-ray high-harmonic generation beyond the single-electron limit

S. Wang, J. Yan, A. de las Heras, S. Song, A. Prodanov, Z. Wu, L. Plaja, D. Popmintchev, T. Popmintchev

Nature Photonics 20 (9), 1092–1098 (2026)

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Field-resolved observation of exciton coherence in a van der Waals magnet

M. Yeung, A. von Hoegen, E. Viñas Boström, F. Zhao, F. Ritzkowsky, J. B. Maier, G. L. Dolso, C. Heide, D. G. Chica, X. Roy, K. K. Berggren, A. Rubio, P. D. Keathley, N. Gedik

Nature Materials 25 (9), 1557–1563 (2026)

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Flux-Floquet Instability in Fluctuating Superconductors

M. Michael, D. De Santis, E. A. Demler, P. A. Lee

Physical Review X 16 (3), 031055 (2026)

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Long-Range Machine Learning of Electron Density for Twisted Bilayer Moiré Materials

Z. Lou, A. M. Lewis, M. Rossi

PRX Intelligence 1 (1), 013015 (2026)

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Toward Accurate RIXS Spectra at Heavy Element Edges: A Relativistic Four-Component and Exact Two-Component TDDFT Approach

L. Konecny, M. A. Dada, D. R. Nascimento, M. Repisky

Journal of Chemical Theory and Computation 22 (16), 8441–8452 (2026)

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Testing electron–photon exchange–correlation functional performance for many-electron systems under weak and strong light–matter coupling

I. Ahmadabadi, I.-T. Lu, L. A. Cunha, M. Ruggenthaler, J. Flick, A. Rubio

The Journal of Chemical Physics 165 (7), 074102 (2026)

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Ferroelectric-assisted charge-transfer plasmons in graphene/CuInP₂S₆

Y. Shao, H. Y. Lee, J. Zhang, S. L. Moore, S. Zhou, C. Drew, A. Rajendran, J. Amontree, T. P. Darlington, D. G. Chica, C.-Y. Huang, S. H. Lee, S. Sarker, K. Watanabe, T. Taniguchi, V. Gopalan, Z. Mao, X.-Y. Zhu, X. Roy, P. J. Schuck, A. Rubio, J. C. Hone, D. N. Basov

Nature Communications 17 (1), 10102 (2026)

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Unified ab initio quantum-electrodynamical density functional theory for cavity-modified electron-phonon-photon coupling in solids

B. Fan, I.-T. Lu, M. Ruggenthaler, A. Rubio

Physical Review B 114 (10), 105111 (2026)

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Comparative study of perturbative and nonequilibrium Green’s function approaches for Floquet sidebands in periodically driven quantum systems

K. Gadge, M. Merboldt, M. Schüler, J. P. Bange, W. Bennecke, M. A. Sentef, M. Reutzel, S. Mathias, S. R. Manmana

Physical Review B 114 (12), 125402 (2026)

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Zeitschriftenartikel

Magnetization of Electronic Ground States in Frustrated Superstable Graphs

F. P. M. Méndez-Córdoba, J. Tindall, D. Jaksch, F. Schlawin

Physical Review Letters 137 (7), 076501 (2026)

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Non-adiabatic perturbation theory of the exact factorization

M. W.-Y. Tu, E. K. U. Gross

The Journal of Chemical Physics 165 (6), 064112 (2026)

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The piezochiral effect

Z. Zeng, M. Först, M. Fechner, X. Deng, A. Cavalleri, P. G. Radaelli

Nature 656 (8127), 338–342 (2026)

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Pulse-Duration-Sensitive High Harmonics and Attosecond Locally Chiral Near Fields from a Chiral Topological Weyl Semimetal

A. de las Heras, Z. Nie, S. Pal, U. de Giovannini, O. Neufeld, A. Rubio

Nano Letters 26 (30), 9722–9731 (2026)

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Continuous unitary transformations using tensor network representations access the full many-body localized spectrum

Q. Liu, J.-N. Herre, D. M. Kennes, C. Karrasch

Physical Review B 144 (9), 094203 (2026)

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Zeitschriftenartikel

Tracking electrons at the space-time limit

S. Maier, R. Spachtholz, K. Glöckl, C. Bustamante, S. Lingl, M. Maczejka, J. Schön, A. Riedel, K. Richter, F. J. Giessibl, F. Bonafé, M. A. Huber, A. Rubio, J. Repp, R. Huber

Nature Photonics 20 (8), 961–967 (2026)

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Ultimate resolution limits in coherent anti-Stokes Raman scattering imaging

G. Sorelli, M. Gessner, F. Schlawin

Optica Quantum 4 (4), 366–373 (2026)

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Zeitschriftenartikel

Linear and Nonlinear Vibrational Excitations Driven by Molecular Polaritons

W. Ying, C. Bustamante, F. Bonafé, R. Richardson, M. Ruggenthaler, M. Sukharev, A. Rubio, A. Nitzan

Journal of Chemical Theory and Computation 22 (14), 7082–7095 (2026)

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Enhanced multiphoton ionization driven by quantum light

V. Kosheleva, S. Panahiyan, A. Rubio, F. Schlawin

Physical Review Research 8 (3), 033106 (2026)

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Zeitschriftenartikel

Parametrically amplified Josephson plasma waves in YBa₂Cu₃O_6+x: Evidence for local superconducting fluctuations up to the pseudogap temperature T^∗

M. H. Michael, E. Demler, P. Lee

Proceedings of the National Academy of Sciences of the United States of America 123 (29), e2606129123 (2026)

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Mixed quantum–classical simulations of intramolecular singlet fission

R. Smorka, J. E. Runeson, M. Thoss, S. R. Reddy, P. B. Coto, J. Mannouch, J. O. Richardson

The Journal of Chemical Physics 165 (3), 034302 (2026)

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Many-body correlations in Floquet steady states: Frequency-resolved renormalization group of the driven Anderson impurity

J.-N. Herre, C. Karrasch, D. M. Kennes

Physical Review B 114 (5), 055113 (2026)

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Zeitschriftenartikel

Emergent interacting phases in the strong-coupling limit of twisted M-valley moiré systems: Application to SnSe₂

M.-R. Li, D. Calugaru, Y. Jiang, H. Pi, A. Fischer, H. Schlömer, L. Klebl, M. G. Vergniory, D. M. Kennes, K. F. Mak, J. Shan, S. A. Parameswaran, H. Yao, B. A. Bernevig, H. Hu

Physical Review B 114 (5), L051113 (2026)

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Perspective on a challenge: Predicting the photochemistry of cyclobutanone

J. Janoš, N. H. List, A. J. Orr-Ewing, J. Suchan, M. Barbatti, O. Bennett, M. Brady, J. Carmona-García, R. Crespo-Otero, J. Eng, O. J. Fajen, M. Garavelli, S. Gómez, A. E. Green, F. J. Hernández, D. Hollas, L. Hutton, L. M. Ibele, A. Kirrander, Z. Lan, Y. Lassmann, J. E. Lawrence, B. G. Levine, D. V. Makhov, J. Mannouch, X. Miao, R. Mitrić, S. M. Parker, T. J. Penfold, J. Peng, J. O. Richardson, D. Shalashilin, P. Slavíček, K. E. Spinlove, P. Vindel-Zandbergen, F. Agostini, S. Bonella, T. J. Martínez, G. A. Worth, B. F. E. Curchod

The Journal of Chemical Physics 165 (2), 020902 (2026)

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Constructing density functional tight-binding parameters for electronic structure modeling of lead-bromide perovskites, perovskitoids, and related structures

J. Jiang, T. van der Heide, S. Thébaud, C. R. Lien-Medrano, A. Fihey, L. Pedesseau, C. Quarti, M. Zacharias, G. Volonakis, M. Kepenekian, B. Aradi, M. A. Sentef, J. Even, C. Katan

The Journal of Chemical Physics 165 (2), 024117 (2026)

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Antiscreening and exciton binding in quasi-one-dimensional systems

F. Bechstedt, S. Grillo, O. Pulci, P. Gori

Applied Physics Letters 129 (1), 013104 (2026)

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An exciting Approach to Theoretical Spectroscopy

M. Raya‐Moreno, A. Buccheri, N. A. Dasch, N. Farahani, I. Gonzalez Oliva, A. Gulans, S. Hong, M. Hossain, H. Kleine, M. Kuban, S. Lubeck, B. Maurer, P. Pavone, F. Peschel, D. Popova‐Gorelova, L. Qiao, E. Richter, S. Rigamonti, R. R. Pela, M. Schebek, K. Sinha, D. T. Speckhard, J. Stutz, S. Tillack, D. Tumakov, J. Užulis, M. Voiculescu, C. Vona, M. Yang, C. Draxl

Advanced Science 13 (47), e76167 (2026)

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Response Regimes in On-Chip THz Spectroscopy

G. Kipp, M. Michael, A. Potts, D. Herrmann, T. Matsuyama, G. Meier, M. Day, H. Bretscher, J. W. McIver

ACS Nano 13 (16), 4530–4538 (2026)

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Bridging scales in polaritonic chemistry: ab initio frameworks with realistic spatially structured cavities [Invited]

C. Bustamante, F. Bonafé, M. K. Svendsen, A. Rubio

Optical Materials Express 16 (7), 2230–2259 (2026)

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Nano–electron volt Fourier-limited transition of a single surface-adsorbed molecule

M. Mirzaei, A. Shkarin, B. Gurlek, J. Zirkelbach, A. J. Shin, I. Deperasińska, B. Kozankiewicz, T. Utikal, S. Götzinger, V. Sandoghdar

Science 392 (6805), 1384–1389 (2026)

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Angular anisotropy landscape of vortex ensembles in polarized small-angle neutron scattering

M. P. Adams, E. M. Jefremovas, A. Michels

Physical Review Research 8 (2), 023328 (2026)

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High-throughput in situ single particle X-ray imaging of dehydrating viral capsids

A. Mall, A. Munke, P. Mazumder, Z. Shen, J. Bielecki, J. E, A. Estillore, C. Kim, R. Letrun, J. Lübke, S. Rafie-Zinedine, A. Round, E. Round, M. Rütten, A. K. Samanta, A. Sarma, T. Sato, F. Schulz, C. Seuring, T. Wollweber, L. Worbs, P. Vagovic, R. Bean, A. P. Mancuso, N.-T. D. Loh, T. Beck, J. Küpper, F. R. N. C. Maia, H. N. Chapman, K. Ayyer

Light: Science & Applications 15 (1), 280 (2026)

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Roadmap on Advancements of the FHI-aims Software Package

J. W. Abbott, C. M. Acosta, A. Akkoush, A. Ambrosetti, V. Atalla, A. Bagrets, J. Behler, D. Berger, H. Bertschi, B. Bieniek, J. Björk, V. Blum, S. Bohloul, C. L. Box, N. Boyer, D. S. Brambila, G. A. Bramley, K. R. Bryenton, M. Camarasa-Gómez, C. Carbogno, F. Caruso, S. Chutia, M. Ceriotti, G. Csányi, W. Dawson, F. A. Delesma, F. Della Sala, B. Delley, R. A. DiStasio, M. Dragoumi, S. Driessen, M. Dvorak, S. Erker, F. Evers, E. Fabiano, M. R. Farrow, F. Fiebig, J. Filser, L. Foppa, L. Gallandi, A. Garcia, R. Gehrke, S. Ghan, L. M. Ghiringhelli, M. Glass, S. Goedecker, D. Golze, M. Gramzow, J. A. Green, A. Grisafi, A. Grüneis, J. Günzl, S. Gutzeit, S. J. Hall, F. Hanke, V. Havu, X. He, J. Hekele, O. Hellman, U. Herath, J. Hermann, D. Hernangómez-Pérez, O. T. Hofmann, J. Hoja, S. Hollweger, L. Hörmann, B. Hourahine, W. B. How, W. P. Huhn, M. Hülsberg, T. Jacob, S. P. Jand, H. Jiang, E. R. Johnson, W. Jürgens, J. M. Kahk, Y. Kanai, K. Kang, P. Karpov, E. Keller, R. Kempt, D. Khan, M. Kick, B. P. Klein, J. Kloppenburg, A. Knoll, F. Knoop, F. Knuth, S. S. Köcher, J. Kockläuner, S. Kokott, T. Körzdörfer, H.-H. Kowalski, P. Kratzer, P. Kůs, R. Laasner, B. Lang, B. Lange, M. F. Langer, A. H. Larsen, H. Lederer, S. Lehtola, M.-O. Lenz-Himmer, M. Leucke, S. Levchenko, A. Lewis, O. A. von Lilienfeld, K. Lion, W. Lipsunen, J. Lischner, Y. Litman, C. Liu, Q.-L. Liu, S. Liu, A. J. Logsdail, M. Lorke, Z. Lou, I. Mandzhieva, A. Marek, J. T. Margraf, R. J. Maurer, T. Melson, F. Merz, J. Meyer, G. S. Michelitsch, T. Mizoguchi, E. Moerman, D. Morgan, J. Morgenstein, J. Moussa, A. S. Nair, L. Nemec, H. Oberhofer, A. Otero-de-la-Roza, R. L. Panadés-Barrueta, T. Patlolla, M. Pogodaeva, A. Pöppl, A. J. A. Price, T. A. R. Purcell, J. Quan, N. Raimbault, M. Rampp, K. Rasim, R. Redmer, X. Ren, K. Reuter, N. A. Richter, S. Ringe, P. Rinke, S. P. Rittmeyer, H. I. Rivera-Arrieta, M. Ropo, M. Rossi, V. Ruiz, N. Rybin, A. Sanfilippo, M. Scheffler, C. Scheurer, C. Schober, F. Schubert, T. Shen, C. Shepard, H. Shang, K. Shibata, A. Sobolev, R. Song, A. Soon, D. T. Speckhard, P. V. Stishenko, E. Stocco, M. N. Tahir, I. Takahara, J. Tang, Z. Tang, T. Theis, F. Theiss, A. Tkatchenko, M. Todorović, G. Trenins, O. T. Unke, Á. Vázquez-Mayagoitia, O. van Vuren, D. Waldschmidt, H. Wang, Y. Wang, J. Wieferink, J. Wilhelm, S. Woodley, J. Xu, Y. Xu, Y. Yao, Y. Yao, M. Yoon, V. W.-z. Yu, Z. Yuan, M. Zacharias, I. Y. Zhang, M.-Y. Zhang, W. Zhang, X. Zhang, R. Zhao, S. Zhao, R. Zhou, Y. Zhou, T. Zhu

Electronic Structure (2026)

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Ultrafast Carrier Dynamics in Methylammonium Lead Iodide (MAPbI3) Perovskite Thin Films With Coexisting Orthorhombic and Tetragonal Phases

Y. Li, Z. Yao, C. Jiao, Z. Wang, F. Schlawin, D. Baranov

Small structures 7 (6), e70515 (2026)

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