MPSD-Publikationen

MPSD-Publikationen

Zeitschriftenartikel (1397)

2024
Zeitschriftenartikel
Cavity-enhanced superconductivity in MgB2 from first-principles quantum electrodynamics (QEDFT)
Proceedings of the National Academy of Sciences of the United States of America 121 (50), e2415061121 (2024)
Zeitschriftenartikel
Floquet Schrieffer-Wolff transform based on Sylvester equations
X. Wang, F. P. M. Méndez-Córdoba, D. Jaksch, F. Schlawin
Physical Review B 110 (24), 245108 (2024)
Zeitschriftenartikel
On-chip petahertz electronics for single-shot phase detection
F. Ritzkowsky, M. Yeung, E. Bebeti, T. Gebert, T. Matsuyama, M. Budden, R. Mainz, H. Cankaya, K. Berggren, G. Rossi, P. Keathley, F. Kärtner
Nature Communications 15 (1), 10179 (2024)
Zeitschriftenartikel
Roadmap on methods and software for electronic structure based simulations in chemistry and materials
V. Blum, R. Asahi, J. Autschbach, C. Bannwarth, G. Bihlmayer, S. Blügel, L. A. Burns, T. D. Crawford, W. Dawson, W. A. de Jong, C. Draxl, C. Filippi, L. Genovese, P. Giannozzi, N. Govind, S. Hammes-Schiffer, J. R. Hammond, B. Hourahine, A. Jain, Y. Kanai, P. R. C. Kent, A. H. Larsen, S. Lehtola, X. Li, R. Lindh, S. Maeda, N. Makri, J. Moussa, T. Nakajima, J. A. Nash, M. J. T. Oliveira, P. D. Patel, G. Pizzi, G. Pourtois, B. P. Pritchard, E. Rabani, M. Reiher, L. Reining, X. Ren, M. Rossi, H. B. Schlegel, N. Seriani, L. V. Slipchenko, A. Thom, E. F. Valeev, B. V. Troeye, L. Visscher, V. Vlček, H.-J. Werner, D. B. Williams-Young, T. Windus
Electronic Structure 6 (4), 042501 (2024)
Zeitschriftenartikel
Supercell Wannier functions and a faithful low-energy model for Bernal bilayer graphene
A. Fischer, L. Klebl, D. M. Kennes, T. O. Wehling
Physical Review B 110 (20), L201113 (2024)
Zeitschriftenartikel
Insulating moiré homobilayers lack a threefold symmetric second-harmonic generation
L. E. Rosas-Hernandez, J. L. Cabellos, A. Huamán, B. S. Mendoza, S. Barraza-Lopez
Physical Review Materials 8 (11), 116203 (2024)
Zeitschriftenartikel
Toward a Correct Description of Initial Electronic Coherence in Nonadiabatic Dynamics Simulations
The Journal of Physical Chemistry Letters 15 (46), 11687–11695 (2024)
Zeitschriftenartikel
Reflection parity and space-time parity photonic conservation laws in parametric nonlinear optics
G. Lerner, M. E. Tzur, O. Neufeld, A. Fleischer, O. Cohen
Physical Review Research 6 (4), L042034 (2024)
Zeitschriftenartikel
Initial electron thermalization in metals measured by attosecond transient absorption spectroscopy
B. R. de Roulet, L. Drescher, S. Sato, S. R. Leone
Physical Review B 110 (17), 174301 (2024)
Zeitschriftenartikel
Probing inhomogeneous cuprate superconductivity by terahertz Josephson echo spectroscopy
A. Liu, D. Pavicevic, M. Michael, A. G. Salvador, P. E. Dolgirev, M. Fechner, A. Disa, P. M. Lozano, Q. Li, G. D. Gu, E. Demler, A. Cavalleri
Nature Physics 20 (11), 1751–1756 (2024)
Zeitschriftenartikel
Solution of the υ-representability problem on a one-dimensional torus
S. M. Sutter, M. Penz, M. Ruggenthaler, R. van Leeuwen, K. J. H. Giesbertz
Journal of Physics A 57 (47), 475202 (2024)
Zeitschriftenartikel
Kagome Hubbard model from a functional renormalization group perspective
J. B. Profe, L. Klebl, F. Grandi, H. Hohmann, M. Dürrnagel, T. Schwemmer, R. Thomale, D. M. Kennes
Physical Review Research 6 (4), 043078 (2024)
Zeitschriftenartikel
Magic angle of Sr2RuO4: Optimizing correlation-driven superconductivity
J. B. Profe, L. C. Rhodes, M. Dürrnagel, R. Bisset, C. A. Marques, S. Chi, T. Schwemmer, R. Thomale, D. M. Kennes, C. Hooley, P. Wahl
Physical Review Research 6 (4), 043057 (2024)
Zeitschriftenartikel
Deep Learning-Based Variational Autoencoder for Classification of Quantum and Classical States of Light
M. Bhupati, A. Mall, A. Kumar, P. K. Jha
Advanced Physics Research (2024)
Zeitschriftenartikel
Correlated topological flat bands in rhombohedral graphite
H. Zhang, Q. Li, M. G. Scheer, R. Wang, C. Tuo, N. Zou, W. Chen, J. Li, X. Cai, C. Bao, M.-R. Li, K. Deng, K. Watanabe, T. Taniguchi, M. Ye, P. Tang, Y. Xu, P. Yu, J. Avila, P. Dudin, J. D. Denlinger, H. Yao, B. Lian, W. Duan, S. Zhou
Proceedings of the National Academy of Sciences of the United States of America 121 (43), e2410714121 (2024)
Zeitschriftenartikel
Phonon collapse and anharmonic melting of the 3D charge-density wave in kagome metals
M. Gutierrez-Amigo, Ð. Dangić, C. Guo, C. Felser, P. J. W. Moll, M. G. Vergniory, I. Errea
Communications Materials 5 (1), 234 (2024)
Zeitschriftenartikel
Geometrical perspective on spin–lattice density-functional theory
M. Penz, R. van Leeuwen
The Journal of Chemical Physics 161 (15), 150901 (2024)
Zeitschriftenartikel
Substrate Interference and Strain in the Second-Harmonic Generation from MoSe2 Monolayers
S. Puri, S. Patel, J. L. Cabellos, L. E. Rosas-Hernandez, K. Reynolds, H. O. H. Churchill, S. Barraza-Lopez, B. S. Mendoza, H. Nakamura
Nano Letters 24 (41), 13061–13067 (2024)
Zeitschriftenartikel
Coordination engineering with crown ethers for perovskite precursor stabilization and defect passivation
Z. Zhang, Y. Yang, Z. Huang, Q. Xu, S. Zhu, M. Li, P. Zhao, H. Cui, S. Li, X. Jin, X. Wu, M. Han, Y. Zhang, N. Zhao, C. Zou, Q. Liang, L. D. Xian, J. Hu, C. Zhu, Y. Chen, Y. Bai, Y. Li, Q. Chen, H. Zhou, B. Zhang, Y. Jiang
Energy & Environmental Science 17 (19), 7182–7192 (2024)
Zeitschriftenartikel
Technical Design Report for the LUXE experiment
H. Abramowicz, M. A. Soto, M. Altarelli, R. Aßmann, A. Athanassiadis, G. Avoni, T. Behnke, M. Benettoni, Y. Benhammou, J. Bhatt, T. Blackburn, C. Blanch, S. Bonaldo, S. Boogert, O. Borysov, M. Borysova, V. Boudry, D. Breton, R. Brinkmann, M. Bruschi, et al.
European Physical Journal - Special Topics 233 (10), 1709–1974 (2024)
Zeitschriftenartikel
Exploring the dynamics of allostery through multi-dimensional crystallography
C. E. Hatton, P. Mehrabi
Biophysical Reviews 16 (5), 563–570 (2024)
Zeitschriftenartikel
Numerical simulation projects in micromagnetics with Jupyter
M. Lonsky, M. Lang, S. Holt, S. A. Pathak, R. Klause, T.-H. Lo, M. Beg, A. Hoffmann, H. Fangohr
American Journal of Physics 92 (10), 794–800 (2024)
Zeitschriftenartikel
Terahertz spectroscopy of collective charge density wave dynamics at the atomic scale
S. Sheng, M. Abdo, S. Rolf-Pissarczyk, K. Lichtenberg, S. Baumann, J. A. J. Burgess, L. Malavolti, S. Loth
Nature Physics 20 (10), 1603–1608 (2024)
Zeitschriftenartikel
Universal correlation between H-linear magnetoresistance and T-linear resistivity in high-temperature superconductors
J. Ayres, M. Berben, C. Duffy, R. Hinlopen, Y.-T. Hsu, A. Cuoghi, M. Leroux, I. Gilmutdinov, M. Massoudzadegan, D. Vignolles, Y. Huang, T. Kondo, T. Takeuchi, S. Friedemann, A. Carrington, C. Proust, N. E. Hussey
Nature Communications 15 (1), 8406 (2024)
Zeitschriftenartikel
Emerging tailored light sources for studying chirality and symmetry
D. Habibović, K. R. Hamilton, O. Neufeld, L. Rego
Nature Reviews Physics 6 (11), 663–675 (2024)
Zeitschriftenartikel
Equilibrium Parametric Amplification in Raman-Cavity Hybrids
H. P. O. Collado, M. Michael, J. Skulte, A. Rubio, L. Mathey
Physical Review Letters 133 (11), 116901 (2024)
Zeitschriftenartikel
Real-time dynamics of angular momentum transfer from spin to acoustic chiral phonon in oxide heterostructures
I. H. Choi, S. G. Jeong, S. Song, S. Park, D. Shin, W. S. Choi, J. S. Lee
Nature Nanotechnology 19 (9), 1277–1282 (2024)
Zeitschriftenartikel
Enhanced high harmonic efficiency through phonon-assisted photodoping effect
npj Computational Materials 10 (1), 202 (2024)
Zeitschriftenartikel
Reliable quantification of uncertainties: the biggest challenge for data-centric materials modelling?
L. M. Ghiringhelli, M. Rossi
Modelling and Simulation in Materials Science and Engineering 32 (6), 13–15 (2024)
Zeitschriftenartikel
Towards efficient and accurate input for data-driven materials science from large-scale all-electron density functional theory (DFT) simulations
S. Kokott, A. Marek, F. Merz, P. Karpov, C. Carbogno, M. Rossi, M. Rampp, V. Blum, M. Scheffler
Modelling and Simulation in Materials Science and Engineering 32 (6), 28–31 (2024)
Zeitschriftenartikel
Principles of two-dimensional terahertz spectroscopy of collective excitations: The case of Josephson plasmons in layered superconductors
A. G. Salvador, P. E. Dolgirev, M. Michael, A. Liu, D. Pavicevic, M. Fechner, A. Cavalleri, E. Demler
Physical Review B 110 (9), 094514 (2024)
Zeitschriftenartikel
Quasi-equilibrium growth of inch-scale single-crystal monolayer α-In2Se3 on fluor-phlogopite
K. Si, Y. Zhao, P. Zhang, X. Wang, Q. He, J. Wei, B. Li, Y. Wang, A. Cao, Z. Hu, P. Tang, F. Ding, Y. Gong
Nature Communications 15 (1), 7471 (2024)
Zeitschriftenartikel
i-PI 3.0: A flexible and efficient framework for advanced atomistic simulations
Y. Litman, V. Kapil, Y. M. Y. Feldman, D. Tisi, T. Begušić, K. Fidanyan, G. Fraux, J. Higer, M. Kellner, T. E. Li, E. S. Pós, E. Stocco, G. Trenins, B. Hirshberg, M. Rossi, M. Ceriotti
The Journal of Chemical Physics 161 (6), 062504 (2024)
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)
Zeitschriftenartikel
Magnetic field expulsion in optically driven YBa2Cu3O6.48
Nature 632 (8023), 75–80 (2024)
Zeitschriftenartikel
Phonon-mediated unconventional superconductivity in rhombohedral stacked multilayer graphene
E. Viñas Boström, A. Fischer, J. B. Hauck, J. Zhang, D. M. Kennes, A. Rubio
npj Computational Materials 10 (1), 163 (2024)
Zeitschriftenartikel
Direct synthesis of controllable ultrathin heteroatoms-intercalated 2D layered materials
Q. He, K. Si, Z. Xu, X. Wang, C. Jin, Y. Yang, J. Wei, L. Meng, P. Zhai, P. Zhang, P. Tang, Y. Gong
Nature Communications 15 (1), 6320 (2024)
Zeitschriftenartikel
Collective Charge Excitations between Moiré Minibands in Twisted WSe2 Bilayers Probed with Resonant Inelastic Light Scattering
N. Saigal, L. Klebl, H. Lambers, S. Bahmanyar, V. Antić, D. M. Kennes, T. O. Wehling, U. Wurstbauer
Physical Review Letters 133 (4), 046902 (2024)
Zeitschriftenartikel
Symmetry-driven anisotropic coupling effect in antiferromagnetic topological insulator: Mechanism for a quantum anomalous Hall state with a high Chern number
Y. Fan, H. Wang, P. Tang, S. Murakami, X. Wan, H. Zhang, D. Xing
Physical Review B 110 (3), 035139 (2024)
Zeitschriftenartikel
Atomic-scale perspective on individual thiol-terminated molecules anchored to single S vacancies in MoS2
J. R. Simon, D. Maksimov, C. Lotze, P. Wiechers, J. P. G. Felipe, B. Kobin, J. Schwarz, S. Hecht, K. J. Franke, M. Rossi
Physical Review B 110 (4), 045407 (2024)
Zeitschriftenartikel
Quantum rates in dissipative systems with spatially varying friction
O. Bridge, P. Lazzaroni, R. Martinazzo, M. Rossi, S. C. Althorpe, Y. Litman
The Journal of Chemical Physics 161 (2), 024110 (2024)
Zeitschriftenartikel
Efficient all-electron hybrid density functionals for atomistic simulations beyond 10 000 atoms
S. Kokott, F. Merz, Y. Yao, C. Carbogno, M. Rossi, V. Havu, M. Rampp, M. Scheffler, V. Blum
The Journal of Chemical Physics 161 (2), 024112 (2024)
Zeitschriftenartikel
Competition between d-wave superconductivity and magnetism in uniaxially strained Sr2RuO4
J. B. Profe, S. Beck, D. M. Kennes, A. Georges, O. Gingras
npj Quantum Materials 9 (1), 53 (2024)
Zeitschriftenartikel
Benchmarking Functionals for Strong-Field Light-Matter Interactions in Adiabatic Time-Dependent Density Functional Theory
The Journal of Physical Chemistry Letters 15 (28), 7254–7264 (2024)
Zeitschriftenartikel
Hot electron effect in high-order harmonic generation from graphene driven by elliptically polarized light
K. Nakagawa, W. Mao, S. Sato, H. Ago, A. Rubio, Y. Kanemitsu, H. Hirori
APL Photonics 9 (7), 076107 (2024)
Zeitschriftenartikel
Elastic moduli from crystalline micro-mechanical oscillators carved by focused ion beam
A. Estry, C. Putzke, C. Guo, M. Bachmann, A. Duvakina, F. Posva, J. Diaz, D. J. Gawryluk, M. Medarde, P. J. W. Moll
Review of Scientific Instruments 95 (7), 073905 (2024)
Zeitschriftenartikel
Hidden Charge Order and Multiple Electronic Instabilities in EuTe4
K. Xiao, W.-H. Dong, X. Wang, J. Yu, D. Fu, Z. Hu, Y. Guo, Q. Zhang, X. Hou, Y. Guo, L. Yang, Y. Xu, P. Tang, W. Duan, Q. Xue, W. Li
Nano Letters 24 (25), 7681–7687 (2024)
Zeitschriftenartikel
A size-consistent multi-state mapping approach to surface hopping
J. E. Lawrence, J. Mannouch, J. O. Richardson
The Journal of Chemical Physics 160 (24), 244112 (2024)
Zeitschriftenartikel
Nonlinear Current Injection in Hexagonal Boron Nitride using Linearly Polarized Light in a Deeply Off-Resonant Regime
Advanced Optical Materials 12 (22), 2400651 (2024)
Zeitschriftenartikel
Power Density Titration of Reversible Photoisomerization of a Fluorescent Protein Chromophore in the Presence of Thermally Driven Barrier Crossing Shown by Quantitative Millisecond Serial Synchrotron X-ray Crystallography
J. M. Baxter, C. D. M. Hutchison, A. Fadini, K. Maghlaoui, V. Cordon-Preciado, R. M. L. Morgan, M. Agthe, S. Horrell, F. Tellkamp, P. Mehrabi, Y. Pfeifer, H. M. Müller-Werkmeister, D. von Stetten, A. R. Pearson, J. J. van Thor
Journal of the American Chemical Society 146 (24), 16394–16403 (2024)
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