Publikationen von Forscher*innen des MPSD

Publikationen von Forscher*innen des MPSD

Zeitschriftenartikel (723)

  1. 2020
    Zeitschriftenartikel
    F. Covito, A. Rubio, und F. G. Eich, Nonadiabatic Electron Dynamics in Tunneling Junctions: Lattice Exchange-Correlation Potential, Journal of Chemical Theory and Computation 16 (1), 295–301 (2020).
  2. Zeitschriftenartikel
    U. de Giovannini und H. Hübener, Floquet analysis of excitations in materials, JPhys Materials 3 (1), 012001 (2020).
  3. Zeitschriftenartikel
    H.-G. Duan, A. Jha, V. Tiwari, R. J. D. Miller, und M. Thorwart, Dissociation and localization dynamics of charge transfer excitons at a donor-acceptor interface, Chemical Physics 528, 110525 (2020).
  4. Zeitschriftenartikel
    J. W. McIver, B. Schulte, F.-U. Stein, T. Matsuyama, G. Jotzu, G. Meier, und A. Cavalleri, Light-induced anomalous Hall effect in graphene, Nature Physics 16 (1), 38–41 (2020).
  5. Zeitschriftenartikel
    S. Sato und A. Rubio, Exact exchange-correlation potential of effectively interacting Kohn-Sham systems, Physical Review A 101 (1), 012510 (2020).
  6. 2019
    Zeitschriftenartikel
    K. Ayyer, A. J. Morgan, A. Aquila, H. DeMirci, B. G. Hogue, R. A. Kirian, L. X. Paulraj, C. H. Yoon, H. N. Chapman, und A. Barty, Low-signal limit of X-ray single particle diffractive imaging, Optics Express 27 (26), 37816–37833 (2019).
  7. Zeitschriftenartikel
    D. Pandey, E. Colomés, G. Albareda Piquer, und X. Oriols, Stochastic Schrödinger Equations and Conditional States: A General Non-Markovian Quantum Electron Transport Simulator for THz Electronics, Entropy 21 (12), 1148 (2019).
  8. Zeitschriftenartikel
    E. Baldini, A. Dominguez, T. Palmieri, O. Cannelli, A. Rubio, P. Ruello, und M. Chergui, Exciton control in a room temperature bulk semiconductor with coherent strain pulses, Science Advances 5 (11), eaax2937 (2019).
  9. Zeitschriftenartikel
    J. Gebhardt und A. M. Rappe, Mix and Match: Organic and Inorganic Ions in the Perovskite Lattice, Advanced Materials 31 (47), 1802697 (2019).
  10. Zeitschriftenartikel
    F. Buchholz, I. Theophilou, S. E. B. Nielsen, M. Ruggenthaler, und A. Rubio, Reduced Density-Matrix Approach to Strong Matter-Photon Interaction, ACS Photonics 6 (11), 2694–2711 (2019).
  11. Zeitschriftenartikel
    J. Flick, D. Welakuh, M. Ruggenthaler, H. Appel, und A. Rubio, Light–Matter Response in Nonrelativistic Quantum Electrodynamics, ACS Photonics 6 (11), 2757–2778 (2019).
  12. Zeitschriftenartikel
    S. Sato, Photovoltaic Effect from the Viewpoint of Time-reversal Symmetry, Journal of the Physical Society of Japan 88 (11), 115003 (2019).
  13. Zeitschriftenartikel
    M. Volkov, S. Sato, F. Schlaepfer, L. Kasmi, N. Hartmann, M. Lucchini, L. Gallmann, A. Rubio, und U. Keller, Attosecond screening dynamics mediated by electron localization in transition metals, Nature Physics 15 (11), 1145–1149 (2019).
  14. Zeitschriftenartikel
    A. A. Athanasopoulou, J. Baldovi, L. M. Carrella, und E. Rentschler, Field-Induced Slow Magnetic Relaxation In the First Dy(III)-centered 12-Metallacrown-4 Double-Decker, Dalton Transactions 48 (41), 15381–15385 (2019).
  15. Zeitschriftenartikel
    L. Inhester, Z. Li, X. Zhu, N. Medvedev, und T. J. A. Wolf, Spectroscopic Signature of Chemical Bond Dissociation Revealed by Calculated Core-Electron Spectra, The Journal of Physical Chemistry Letters 10 (21), 6536–6544 (2019).
  16. Zeitschriftenartikel
    R. Tuovinen, F. Covito, und M. A. Sentef, Efficient computation of the second-Born self-energy using tensor-contraction operations, The Journal of Chemical Physics 151 (17), 174110 (2019).
  17. Zeitschriftenartikel
    D. P. Meka, R. Scharrenberg, B. Zhao, O. Kobler, T. König, I. Schaefer, B. Schwanke, S. Klykov, M. Richter, D. Eggert, S. Windhorst, C. G. Dotti, M. R. Kreutz, M. Mikhaylova, und F. C. de Anda, Radial somatic F‐actin organization affects growth cone dynamics during early neuronal development, EMBO Reports 20 (11), e47743 (2019).
  18. Zeitschriftenartikel
    J. Baldovi und A. Rubio, Zweidimensionale Revolution, Spektrum der Wissenschaft 11.19, 52–601675652 (2019).
  19. Zeitschriftenartikel
    C. Covington, D. Kidd, H. Buckner, H. Appel, und K. Varga, Time propagation of the coupled Maxwell and Kohn-Sham equations using the Riemann-Silberstein formalism, Physical Review E 100 (5), 053301 (2019).
  20. Zeitschriftenartikel
    S. Giménez-Santamarina⁠, S. Cardona-Serra, und J. Baldovi, Exploring the transport properties of equatorially low-coordinated erbium single ion magnets, Journal of Magnetism and Magnetic Materials 489, 165455 (2019).
  21. Zeitschriftenartikel
    M.-L. Tchenkoue Djouom, M. Penz, I. Theophilou, M. Ruggenthaler, und A. Rubio, Force balance approach for advanced approximations in density functional theories, The Journal of Chemical Physics 151 (15), 154107 (2019).
  22. Zeitschriftenartikel
    R. Tuovinen, E. Perfetto, R. van Leeuwen, G. Stefanucci, und M. A. Sentef, Distinguishing Majorana zero modes from impurity states through time-resolved transport, New Journal of Physics 21, 103038 (2019).
  23. Zeitschriftenartikel
    A. V. Dostovalov, T. Derrien, S. A. Lizunov, F. Přeučil, K. A. Okotrub, T. Mocek, V. P. Korolkov, S. A. Babin, und N. M. Bulgakova, LIPSS on thin metallic films: New insights from multiplicity of laser-excited electromagnetic modes and efficiency of metal oxidation, Applied Surface Science 491, 650–658 (2019).
  24. Zeitschriftenartikel
    M. Kalthoff, D. M. Kennes, und M. A. Sentef, Floquet-engineered light-cone spreading of correlations in a driven quantum chain, Physical Review B 100 (16), 165125 (2019).
  25. Zeitschriftenartikel
    J. M. Bofill, J. Ribas-Ariño, R. Valero, G. Albareda Piquer, I. de P. R. Moreira, und W. Quapp, Interplay between the Gentlest Ascent Dynamics Method and Conjugate Directions to Locate Transition States, Journal of Chemical Theory and Computation 15 (10), 5426–5439 (2019).
  26. Zeitschriftenartikel
    U. Mordovina, T. Reinhard, I. Theophilou, H. Appel, und A. Rubio, Self-Consistent Density-Functional Embedding: A Novel Approach for Density-Functional Approximations, Journal of Chemical Theory and Computation 15 (10), 5209–5220 (2019).
  27. Zeitschriftenartikel
    A. Castro, H. Appel, und A. Rubio, Optimal control theory for quantum electrodynamics: an initial state problem, European Physical Journal B 92 (10), 223 (2019).
  28. Zeitschriftenartikel
    L. Escalera-Moreno und J. Baldovi, Unveiling the Effect of Magnetic Noise in the Coherence of Single-Molecule Quantum Processors, Frontiers in Chemistry 7, 662 (2019).
  29. Zeitschriftenartikel
    P. Mehrabi, E.-C. Schulz, M. Agthe, S. Horrell, G. Bourenkov, D. von Stetten, J.-P. Leimkohl, H. Schikora, T. R. Schneider, A. R. Pearson, F. Tellkamp, und R. J. D. Miller, Liquid application method for time-resolved analyses by serial synchrotron crystallography, Nature methods 16 (10), 979–982 (2019).
  30. Zeitschriftenartikel
    G. Topp, G. Jotzu, J. W. McIver, L. D. Xian, A. Rubio, und M. A. Sentef, Topological Floquet engineering of twisted bilayer graphene, Physical Review Research 1 (2), 023031 (2019).
  31. Zeitschriftenartikel
    J. Castells-Gil, S. Mañas-Valero, I. J. Vitórica-Yrezábal, D. Ananias, J. Rocha, R. Santiago, S. T. Bromley, J. Baldovi, E. Coronado, M. Soutoa, und G. M. Espallargasa, Electronic, Structural and Functional Versatility in Tetrathiafulvalene-Lanthanide Metal-Organic Frameworks, Chemistry – A European Journal 25 (54), 12636–12643 (2019).
  32. Zeitschriftenartikel
    H.-G. Duan, M. Thorwart, und R. J. D. Miller, Does electronic coherence enhance anticorrelated pigment vibrations under realistic conditions?, The Journal of Chemical Physics 151 (11), 114115 (2019).
  33. Zeitschriftenartikel
    L. Escalera-Moreno, J. Baldovi, A. Gaita-Ariño, und E. Coronado, Exploring the High-Temperature Frontier in Molecular Nanomagnets: From Lanthanides to Actinides, Inorganic Chemistry 58 (18), 11883–11892 (2019).
  34. Zeitschriftenartikel
    P. Mehrabi, E.-C. Schulz, R. Dsouza, H. Müller-Werkmeister, F. Tellkamp, R. J. D. Miller, und E. F. Pai, Time-resolved crystallography reveals allosteric communication aligned with molecular breathing, Science 365 (6458), 1167–1170 (2019).
  35. Zeitschriftenartikel
    S. Bittmann, R. Dsouza, K. M. Siddiqui, S. A. Hayes, A. Rossos, G. Corthey, M. Kochman, V. Prokhorenko, R. S. Murphy, H. Schwoerer, und R. J. D. Miller, Ultrafast ring-opening and solvent-dependent product relaxation of photochromic spironaphthopyran, Physical Chemistry Chemical Physics 21 (33), 18119–18127 (2019).
  36. Zeitschriftenartikel
    S. Sato, P. Tang, M. A. Sentef, U. de Giovannini, H. Hübener, und A. Rubio, Light-induced anomalous Hall effect in massless Dirac fermion systems and topological insulators with dissipation, New Journal of Physics 21, 093005 (2019).
  37. Zeitschriftenartikel
    G. Carleo, K. Choo, D. Hofmann, J. E. T. Smith, T. Westerhout, F. Alet, E. J. Davis, S. Efthymiou, I. Glasser, S.-H. Lin, M. Mauri, G. Mazzola, C. B. Mendl, E. van Nieuwenburg, O. O’Reilly, H. Théveniaut, G. Torlai, F. Vicentini, und A. Wietek, NetKet: A machine learning toolkit for many-body quantum systems, SoftwareX 10, 100311 (2019).
  38. Zeitschriftenartikel
    I. Cimatti, L. Bondì, G. Serrano, L. Malavolti, B. Cortigiani, E. Velez-Fort, D. Betto, A. Ouerghi, N. B. Brookes, S. Loth, M. Mannini, F. Totti, und R. Sessolia, Vanadyl phthalocyanines on graphene/SiC(0001): toward a hybrid architecture for molecular spin qubits, Nanoscale Horizons 4 (5), 1202–1210 (2019).
  39. Zeitschriftenartikel
    L. Lacombe, N. Hoffmann, und N. T. Maitra, Exact Potential Energy Surface for Molecules in Cavities, Physical Review Letters 123 (8), 083201 (2019).
  40. Zeitschriftenartikel
    M. Lüders, P. Cudazzo, G. Profeta, A. Continenza, S. Massidda, A. Sanna, und E. K. U. Gross, Direct evaluation of the isotope effect within the framework of density functional theory for superconductors, Journal of Physics: Condensed Matter 31 (33), 334001 (2019).
  41. Zeitschriftenartikel
    S. M. Jung, J. Park, D. Shin, H. Y. Jeong, D. Lee, I. Y. Jeon, H. Cho, N. Park, J. W. Yoo, und J. B. Baek, Paramagnetic Carbon Nanosheets with Random Hole Defects and Oxygenated Functional Groups, Angewandte Chemie International Edition 58 (34), 11670–11675 (2019).
  42. Zeitschriftenartikel
    D. M. Kennes, M. Claassen, M. A. Sentef, und C. Karrasch, Light-induced d-wave superconductivity through Floquet-engineered Fermi surfaces in cuprates, Physical Review B 100 (7), 075115 (2019).
  43. Zeitschriftenartikel
    L. D. Xian, D. M. Kennes, N. Tancogne-Dejean, M. Altarelli, und A. Rubio, Multiflat Bands and Strong Correlations in Twisted Bilayer Boron Nitride: Doping-Induced Correlated Insulator and Superconductor, Nano Letters 19 (8), 4934–4940 (2019).
  44. Zeitschriftenartikel
    L. Martel, A. Rakhmatullin, J. Baldovi, M. Perfetti, K. Popa, M. Deschamps, T. Gouder, E. Colineau, A. Kovács, und J.-C. Griveau, Local structure and magnetism of LaxEu1−xPO4 solid solutions, Physical Review B 100 (5), 054412 (2019).
  45. Zeitschriftenartikel
    M. Porer, M. Fechner, M. Kubli, M. J. Neugebauer, S. Parchenko, V. Esposito, A. Narayan, N. A. Spaldin, R. Huber, M. Radovic, E. M. Bothschafter, J. M. Glownia, T. Sato, S. Song, S. L. Johnson, und U. Staub, Ultrafast transient increase of oxygen octahedral rotations in a perovskite, Physical Review Research 1 (1), 012005 (2019).
  46. Zeitschriftenartikel
    M. Ridley, M. A. Sentef, und R. Tuovinen, Electron Traversal Times in Disordered Graphene Nanoribbons, Entropy 21 (8), 737 (2019).
  47. Zeitschriftenartikel
    M. Claassen, D. M. Kennes, M. Zingl, M. A. Sentef, und A. Rubio, Universal Optical Control of Chiral Superconductors and Majorana Modes, Nature Physics 15, 766–770 (2019).
  48. Zeitschriftenartikel
    A. Kerelsky, L. J. McGilly, D. M. Kennes, L. D. Xian, M. Yankowitz, S. Chen, K. Watanabe, T. Taniguchi, J. Hone, C. Dean, A. Rubio, und A. N. Pasupathy, Maximized electron interactions at the magic angle in twisted bilayer graphene, Nature 572 (7767), 95–100 (2019).
  49. Zeitschriftenartikel
    Q. Zhang, M. L. Baker, S. Li, M. P. Sarachik, J. Baldovi, A. Gaita-Ariño, E. Coronado, D. I. Alexandropoulos, und T. C. Stamatatos, Experimental Determination of Single Molecule Toroic Behaviour in a Dy8 Single-Molecule Magnet, Nanoscale 11 (32), 15131–15138 (2019).
  50. Zeitschriftenartikel
    V. Rokaj, M. Penz, M. A. Sentef, M. Ruggenthaler, und A. Rubio, Quantum Electrodynamical Bloch Theory with Homogeneous Magnetic Fields, Physical Review Letters 123 (4), 047202 (2019).
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