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Publications

Read the latest papers published by our researchers.

  1. Controlled introduction of defects to delafossite metals by electron irradiation

    Physical Review X, arXiv:2001.01471, April 24, 2020

    V. Sunko, P. H. McGuinness, C. S. Chang, E. Zhakina, S. Khim, C. Dreyer, et al.

  2. A systematic study of stacked square nets: from Dirac fermions to material realizations

    Physical Review B, arXiv:1910.14036, April 20, 2020

    Sebastian Klemenz, Leslie Schoop, and J. Cano

  3. Setting the photoelectron clock through molecular alignment

    arXiv:1802.06622, April 17, 2020

    Andrea Trabattoni, Joss Wiese, Umberto De Giovannini, Jean François Olivieri, Terry Mullins, Jolijn Onvlee, et al.

  4. Multimode Organic Polariton Lasing

    arXiv:2004.06679, April 15, 2020

    Kristin B. Arnardottir, Antti J. Moilanen, A. Strashko, Päivi Törmä, and Jonathan Keeling

  5. Realization of Nearly Dispersionless Bands with Strong Orbital Anisotropy from Destructive Interference in Twisted Bilayer MoS2

    arXiv:2004.02964, 2020

    L. Xian, M. Claassen, D. Kiese, M. Scherer, S. Trebst, D. Kennes, et al.

  6. Electronic correlations in nodal-line semimetals

    arxiv:, April 1, 2020

    Yinming and A. N. Rudenko and Jin Hu and Zhiyuan Sun and Yanglin Zhu and Seongphill Moon and Shao

  7. Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems

    J. Chem. Phys., arXiv:1912.07921, March 31, 2020

    N. Tancone-Dejean, M. J. T. Oliveira, X. Andrade, H. Appel, C. H. Borca, G. Le Breton, et al.

  8. Long-range quadrupole electron-phonon interaction from first principles

    arXiv:2003.13782, March 30, 2020

    Jinsoo Park, Jin-Jian Zhou, Vatsal A. Jhalani, C. Dreyer, and Marco Bernardi

  9. Excitons in Solids from Periodic Equation-of-Motion Coupled-Cluster Theory

    J. Chem. Theory Comput., arXiv:2001.11050, March 28, 2020

    X. Wang and T. Berkelbach

  10. ABINIT: Overview and focus on selected capabilities

    Journal of Chemical Physics, March 24, 2020

    Aldo H. Romero, Douglas C. Allan, Bernard Amadon Gabriel Antonius, Thomas Applencourt, Lucas Baguet, Jordan Bieder, et al.

  11. What limits the simulation of quantum computers?

    Physical Review X, arxiv:2002.07730, 2020

    Yiqing Zhou, M. Stoudenmire, and Xavier Waintal

  12. Emerging chiral edge states from the confinement of a magnetic Weyl semimetal in Co3Sn2S2

    Physical Review B, March 20, 2020

    L. Muechler, E. Liu, J. Gayles, Q. Xu, C. Felser, and Y. Sun

  13. The role of delocalized chemical bonding in square-net-based topological semimetals

    Journal of the American Chemical Society, arXiv:2002.04611, March 6, 2020

    Sebastian Klemenz, Aurland K. Hay, Samuel M. L. Teicher, Andreas Topp, J. Cano, and Leslie M. Schoop

  14. Machine learning quantum states in the NISQ era

    Annual Review of Condensed Matter Physics, arXiv:1905.04312, March 2, 2020

    G. Torlai and Roger G. Melko

  15. One-dimensional flat bands in twisted bilayer germanium selenide

    Nature Communications, arXiv:1905.04025, February 28, 2020

    L. Xian, D. M. Kennes, M. Claassen, and A. Rubio

  16. Ab Initio Linear and Pump-Probe Spectroscopy of Excitons in Molecular Crystals

    Journal of Physical Chemistry: Letters, arXiv:1909.11144, February 28, 2020

    A. M. Lewis and T. Berkelbach

  17. Finite temperature density matrix embedding theory

    Phys. Rev. B, arxiv:1911.07439, 2020

    Chong Sun, Ushnish Ray, Zhi-Hao Cui, M. Stoudenmire, M. Ferrero, and G. Chan

  18. Weak-to-Strong Light-Matter Coupling and Dissipative Dynamics from First Principles

    arXiv:2002.10461, February 24, 2020

    D. S. Wang, T. Neuman, J. Flick, and P. Narang

  19. Direct comparison of many-body methods for realistic electronic Hamiltonians

    Physical Review X, arXiv:1910.00045, February 20, 2020

    K. T. Williams, Y. Yao, Jia Li, L. Chen, H. Shi, M. Motta, et al.

  20. Piezoelectric Electron-Phonon Interaction from Ab Initio Dynamical Quadrupoles: Impact on Charge Transport in Wurtzite GaN

    arXiv:2002.08351, February 19, 2020

    Vatsal A. Jhalani, Jin-Jian Zhou, Jinsoo Park, C. Dreyer, and Marco Bernardi

  21. Biexciton Condensation in Electron-hole Doped Hubbard Bilayers -- A Sign-Problem-Free Quantum Monte Carlo Study

    Phys. Rev. Lett., arXiv:1809.06439, February 19, 2020

    X.-X. Huang, M. Claassen, E. W. Huang, B. Moritz, and T. P. Devereaux

  22. Deconfined critical point in a doped random quantum Heisenberg magnet

    arXiv:1912.08822, February 18, 2020

    Darshan G. Joshi, Chenyuan Li, Grigory Tarnopolsky, A. Georges, and S. Sachdev

  23. Photoenhanced excitonic correlations in a Mott insulator with nonlocal interactions

    Physical Review B, arXiv:1910.07063, 2020

    Nikolaj Bittner, D. Golez, Martin Eckstein, and P. Werner

  24. Signatures of Sixfold Degenerate Exotic Fermions in a Superconducting Metal PdSb2

    Advanced Materials, February 9, 2020

    N. Kumar, M. Yao, J. Nayak, M. G. Vergniory, J. Bannies, Z. Wang, et al.

  25. Probing spin correlations using angle resolved photoemission in a coupled metallic/Mott insulator system

    Science Advances, arXiv:1809.08972, February 7, 2020

    V. Sunko, F. Mazzola, S. Kitamura, S. Khim, P. Kushwaha, O.J. Clark, et al.

  26. Higher-order topological insulators in antiperovskites

    arXiv:2002.02969, February 7, 2020

    Yuan Fang and J. Cano

  27. Quantitative functional renormalization-group description of the two-dimensional Hubbard model

    arXiv:2002.02733, February 7, 2020

    C. Hille, F. B. Kugler, C. J. Eckhardt, Y. He, A.Kauch, C. Honerkamp, et al.

  28. Modular Arithmetic with Nodal Lines: Drumhead Surface States in ZrSiTe

    Physical Review X, arXiv:1909.02154, February 6, 2020

    L. Muechler, Andreas Topp, Raquel Queiroz, Maxim Krivenkov, Andrei Varykhalov, J. Cano, et al.

  29. Covalent C–N Bond Formation through a Surface Catalyzed Thermal Cyclodehydrogenation

    arxiv:, February 1, 2020

    Ilya Piskun, Raymond Blackwell, Joaquim Jornet-Somoza, Fangzhou Zhao, A. Rubio, Steven G. Louie, et al.

  30. Attosecond timing of the dynamical Franz–Keldysh effect

    arxiv:, February 1, 2020

    M Lucchini, S A Sato, F Schlaepfer, K Yabana, L Gallmann, A. Rubio, et al.

  31. Strong and Fragile Topological Dirac Semimetals with Higher-Order Fermi Arcs

    Nature Communications, arXiv:1908.00016, January 31, 2020

    Benjamin J. Wieder, Zhijun Wang, J. Cano, Xi Dai, Leslie M. Schoop, Barry Bradlyn, et al.

  32. Observation of high-temperature quantum anomalous Hall regime in intrinsic MnBi2Te4/Bi2Te3 superlattice

    arXiv:2001.10579, January 28, 2020

    Haiming Deng, Zhiyi Chen, Agnieszka Wolos, Marcin Konczykowski, Kamil Sobczak, Joanna Sitnicka, et al.

  33. Electromagnetic coupling in tight-binding models for strongly correlated light and matter

    arXiv:2001.09726, 2020

    Jiajung Li, D. Golez, Giacomo Mazza, A. Millis, A. Georges, and Martin Eckstein

  34. A Multi-Scale Tensor Network Architecture for Classification and Regression

    arxiv:2001.08286, 2020

    Justin Reyes and M. Stoudenmire

  35. A topological classification of molecules and chemical reactions with a perplectic structure

    Phys. Rev. B, arxiv:1812.08814, January 22, 2020

    L. Muechler

  36. Light-matter interactions within the Ehrenfest–Maxwell–Pauli–Kohn–Sham framework: fundamentals, implementation, and nano-optical applications

    Advances in Physics, January 21, 2020

    René Jestädt, Michael Ruggenthaler, Micael J. T. Oliveira, A. Rubio, and Heiko Appel

  37. Strong Spin-Orbit Quenching via the Product Jahn-Teller Effect in Neutral Group IV Artificial Atom Qubits in Diamond

    arXiv:2001.07743, January 21, 2020

    C. J. Ciccarion, J. Flick, I. B. Harris, M. E. Trusheim, D. R. Englund, and P. Narang

  38. Crescent states in charge-imbalanced polariton condensates

    arXiv:2001.07726, January 21, 2020

    A. Strashko, F.M. Marchetti, A.H. MacDonald, and J. Keeling

  39. Predicting Ligand-Dissociation Energies of 3d Coordination Complexes with Auxiliary-Field Quantum Monte Carlo

    arXiv:2001.07261, January 20, 2020

    Benjamin Rudshteyn, Dilek Coskun, John L. Weber, Evan J. Arthur, S. Zhang, David R. Reichman, et al.

  40. Exact exchange-correlation potential of effectively interacting Kohn-Sham systems

    Physical Review A, arXiv:1907.00183, January 15, 2020

    Shunsuke A. Sato and A. Rubio

  41. Photo-molecular high temperature superconductivity

    arXiv:2001.05389, January 15, 2020

    M. Buzzi, D. Nicoletti, M. Fechner, N. Tancogne-Dejean, M. A. Sentef, A. Georges, et al.

  42. Super-exchange mechanism and quantum many body excitations in the archetypal hemocyanin/tyrosinase di-Cu oxo-bridge

    Communications Physics, arXiv:1811.05739, January 13, 2020

    Mohamed Ali al-Badri, Edward Linscott, A. Georges, Daniel J. Cole, and Cédric Weber

  43. Negative absolute conductivity in photoexcited metals

    Physical Review B, arXiv:1910.10044, January 13, 2020

    Giuliano Chiriacò, A. Millis, and Igor L. Aleiner

  44. Collective modes and THz near field response of superconductors

    arXiv:2001.03704, January 11, 2020

    Zhiyuan Sun, M. M. Fogler, D. N. Basov, and A. Millis

  45. Special topic on dynamics of open quantum systems

    J. Chem. Phys., January 10, 2020

    T. Berkelbach and M. Thoss

  46. Comparative study of nonequilibrium insulator-to-metal transitions in electron-phonon systems

    Physical Review B, arXiv:1810.01598, 2020

    Sharareh Sayyad, Rok žitko, H. Strand, P. Werner, and D. Golez

  47. Imaginary-time matrix product state impurity solver in a real material calculation: Spin-orbit coupling in Sr2RuO4

    Phys. Rev. B (Rapid Commun.), arXiv:1909.02503, January 6, 2020

    N.-O. Linden, M. Zingl, C. Hubig, O. Parcollet, and U. Schollwöck

  48. Strongly correlated materials from a numerical renormalization group perspective: How the Fermi-liquid state of Sr2RuO4 emerges

    Phys. Rev. Lett., arXiv:1909.02389, January 2, 2020

    F. B. Kugler, M. Zingl, H. Strand, S.-S. B. Lee, J. von Delft, and A. Georges