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    Theory and Methods Developing the methods and algorithms to make the quantum many-body problem tractable.

    Quantum Materials Combining chemical realism with many-electron physics to develop predictive theories of many-electron properties.

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Flatiron Institute Computational Quantum Physics

Computational Quantum Physics: Publications

Read the latest papers published by our researchers.

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  1. A structural optimization algorithm with stochastic forces and stresses

    arxiv:2204.12074, November 1, 2022

    Siyuan Chen and S. Zhang

  2. libdlr: Efficient imaginary time calculations using the discrete Lehmann representation

    Computer Physics Communications, arxiv:2110.06765, 2022

    J. Kaye, Kun Chen, and Hugo U. R. Strand

  3. Observation of room temperature excitons in an atomically thin topological insulator

    arxiv:, October 23, 2022

    Marcin Syperek, Raul Stühler, Armando Consiglio, Paweł Holewa, Paweł Wyborski, Łukasz Dusanowski, et al.

  4. Fragmented Cooper Pair Condensation in Striped Superconductors

    arxiv:2202.05850, October 1, 2022

    A. Wietek

  5. Tunable stripe order and weak superconductivity in the Moiré Hubbard model

    arxiv:2204.04229, October 1, 2022

    A. Wietek, J. Wang, J. Zang, J. Cano, A. Georges, and A. Millis

  6. Class of distorted Landau levels and Hall phases in a two-dimensional electron gas subject to an inhomogeneous magnetic field

    arxiv:2201.05069, October 1, 2022

    Dominik Sidler, Vasil Rokaj, Michael Ruggenthaler, and A. Rubio

  7. Entanglement and Charge-Sharpening Transitions in U(1) Symmetric Monitored Quantum Circuits

    arxiv:2107.10279, October 1, 2022

    Utkarsh Agrawal, Aidan Zabalo, K. Chen, Justin H. Wilson, Andrew C. Potter, J. H. Pixley, et al.

  8. Simulating Terahertz Field-Induced Ferroelectricity in Quantum Paraelectric SrTiO

    arxiv:2106.03957, October 1, 2022

    Dongbin Shin, Simone Latini, Christian Schäfer, Shunsuke A. Sato, Edoardo Baldini, Umberto De Giovannini, et al.

  9. Aubry-André Anderson model: Magnetic impurities coupled to a fractal spectrum

    arxiv:2205.06264, October 1, 2022

    Ang-Kun Wu, D. Bauernfeind, Sarang Gopalakrishnan, Kevin Ingersent, and J. H. Pixley

  10. Floquet engineering the band structure of materials with optimal control theory

    arxiv:2203.03387, September 1, 2022

    Alberto Castro, Umberto De Giovannini, Shunsuke A. Sato, Hannes Hübener, and A. Rubio

  11. Wavefunction embedding for molecular polaritons

    arxiv:2204.01777, September 1, 2022

    Pavošević,Fabijan and A. Rubio

  12. Valley selectivity of soft x-ray excitations of core electrons in two-dimensional transition metal dichalcogenides

    arxiv:2111.15385, September 1, 2022

    Andrey Geondzhian, A. Rubio, and Massimo Altarelli

  13. Large-N theory of critical Fermi surfaces. II. Conductivity

    arxiv:2207.08841, September 1, 2022

    Haoyu Guo, Aavishkar A. Patel, Ilya Esterlis, and S. Sachdev

  14. Charge transfer in ultrafast isomerization of acetylene ions

    arxiv:, September 1, 2022

    Wan-Dong Yu, Hao Liang, Cong-Zhang Gao, Shunsuke A. Sato, Bao-Ren Wei, Alberto Castro, et al.

  15. Ultralocalized Optoelectronic Properties of Nanobubbles in 2D Semiconductors

    arxiv:2208.14518, September 1, 2022

    Sara Shabani, Thomas P. Darlington, Colin Gordon, Wenjing Wu, Emanuil Yanev, James Hone, et al.

  16. Order, disorder, and monopole confinement in the spin-1/2 XXZ model on a pyrochlore tube

    Physical Review B, August 18, 2022

    C. Feng, A. Wietek, M. Stoudenmire, and Rajiv R. P. Singh

  17. Generalization and Overfitting in Matrix Product State Machine Learning Architectures

    arXiv:2208.04372, August 8, 2022

    A. Strashko and M. Stoudenmire

  18. Exchange-correlation effect in the charge response of a warm dense electron gas

    arxiv:2205.12861, August 1, 2022

    Peng-Cheng Hou, Bao-Zong Wang, K. Haule, Youjin Deng, and K. Chen

  19. Low-energy interband transition in the infrared response of the correlated metal SrVO

    arxiv:, August 1, 2022

    Gihyeon Ahn, M. Zingl, S. J. Noh, M. Brahlek, Joseph D. Roth, Roman Engel-Herbert, et al.

  20. Optical conductivity of the two-dimensional Hubbard model: Vertex corrections, emergent Galilean invariance, and the accuracy of the single-site dynamical mean field approximation

    arxiv:2205.09217, August 1, 2022

    Anqi Mu, Zhiyuan Sun, and Andrew J. Millis

  21. Time- and angle-resolved photoelectron spectroscopy of strong-field light-dressed solids: Prevalence of the adiabatic band picture

    arxiv:2204.14157, August 1, 2022

    Ofer Neufeld, Wenwen Mao, Hannes Hübener, Nicolas Tancogne-Dejean, Shunsuke A. Sato, Umberto De Giovannini, et al.

  22. Order, disorder, and monopole confinement in the spin-12 XXZ model on a pyrochlore tube

    arxiv:2203.00032, August 1, 2022

    C. Feng, A. Wietek, E. Miles Stoudenmire, and Rajiv R. P. Singh

  23. Ultra-strong spin–orbit coupling and topological moiré engineering in twisted ZrS2 bilayers

    arxiv:2110.13370, August 1, 2022

    M. Claassen, Lede Xian, Dante M. Kennes, and A. Rubio

  24. A high-order integral equation-based solver for the time-dependent Schrödinger equation

    Comm. Pure Appl. Math., arXiv:2001.06113, 2022

    J. Kaye, A. Barnett, and L. Greengard

  25. Nanoscale Femtosecond Dynamics of Mott Insulator (Ca0.99Sr0.01)2RuO4

    arxiv:, July 27, 2022

    Rocco A. Vitalone, Aaron J. Sternbach, Benjamin A. Foutty, Alexander S. McLeod, Chanchal Sow, D. Golez, et al.

  26. Effect of spin-orbit coupling on the high harmonics from the topological Dirac semimetal Na3Bi

    arxiv:2103.09322, July 6, 2022

    Nicolas Tancogne-Dejean, Florian G. Eich, and A. Rubio

  27. Bath-induced delocalization in interacting disordered spin chains

    arxiv:, July 1, 2022

    D. Sels

  28. Terahertz-induced high-order harmonic generation and nonlinear charge transport in graphene

    arxiv:2203.07649, July 1, 2022

    Wenwen Mao, A. Rubio, and Shunsuke A. Sato

  29. Electronic structure of the highly conductive perovskite oxide SrMoO

    arxiv:2203.05820, July 1, 2022

    E. Cappelli, A. Hampel, A. Chikina, E. Bonini Guedes, G. Gatti, A. Hunter, et al.

  30. Surface plasmons induce topological transition in graphene/α-MoO

    arxiv:, June 28, 2022

    Francesco L. Ruta, Brian S. Y. Kim, Zhiyuan Sun, Daniel J. Rizzo, Alexander S. McLeod, Anjaly Rajendran, et al.

  31. Unconventional excitonic states with phonon sidebands in layered silicon diphosphide

    arxiv:2206.08030, June 1, 2022

    Ling Zhou, Junwei Huang, Lukas Windgaetter, Chin Shen Ong, Xiaoxu Zhao, Caorong Zhang, et al.

  32. Ab Initio Cluster Approach for High Harmonic Generation in Liquids

    arxiv:2203.04707, June 1, 2022

    Ofer Neufeld, Zahra Nourbakhsh, Nicolas Tancogne-Dejean, and A. Rubio

  33. Trigonal symmetry breaking and its electronic effects in the two-dimensional dihalides MX

    arxiv:2110.04665, June 1, 2022

    Alexandru B. Georgescu, Andrew J. Millis, and James M. Rondinelli

  34. Probing phonon dynamics with multidimensional high harmonic carrier-envelope-phase spectroscopy

    arxiv:2203.05033, June 1, 2022

    Ofer Neufeld, Jin Zhang, Umberto De Giovannini, Hannes Hübener, and A. Rubio

  35. Strongly correlated electron--photon systems

    arxiv:, June 1, 2022

    Jacqueline Bloch, Andrea Cavalleri, V. Galitski, M. Hafezi, and A. Rubio

  36. Quantifying the role of the lattice in metal--insulator phase transitions

    arxiv:, May 31, 2022

    Alexandru B. Georgescu and Andrew J. Millis

  37. Few-Femtosecond Dynamics of Free-Free Opacity in Optically Heated Metals

    arxiv:, May 1, 2022

    A. Niedermayr, M. Volkov, S. A. Sato, N. Hartmann, Z. Schumacher, S. Neb, et al.

  38. Nonequilibrium phase transition in a driven-dissipative quantum antiferromagnet

    arxiv:2107.03841, May 1, 2022

    Mona H. Kalthoff, Dante M. Kennes, Andrew J. Millis, and Michael A. Sentef

  39. Polaritonic Hofstadter Butterfly and Cavity-Control of the Quantized Hall Conductance

    arxiv:2109.15075, May 1, 2022

    Vasil Rokaj, Markus Penz, Michael A. Sentef, Michael Ruggenthaler, and A. Rubio

  40. Second-order magnetic responses in quantum magnets: Magnetization under ac magnetic fields

    arxiv:2203.02145, May 1, 2022

    Tatsuya Kaneko, Yuta Murakami, Shintaro Takayoshi, and Andrew J. Millis

  41. Superconductivity and Antiferromagnetism in NdNiO

    Physical Review B, arxiv:2201.10481, May 1, 2022

    Jonathan Karp, A. Hampel, and A. Millis

  42. Application of Pontryagin's maximum principle to quantum metrology in dissipative systems

    arxiv:2205.00112, April 1, 2022

    Chungwei Lin, Yanting Ma, and D. Sels

  43. Comment on “Origin of symmetry-forbidden high-order harmonic generation in the time-dependent Kohn-Sham formulation”

    Physical Review A, arxiv:, April 1, 2022

    Ofer Neufeld, Nicolas Tancogne-Dejean, and A. Rubio

  44. Higher-order Van Hove singularity in magic-angle twisted trilayer graphene

    arxiv:2106.14911, February 1, 2022

    D. Guerci, Pascal Simon, and Christophe Mora

  45. Moiré engineering of spin--orbit coupling in twisted platinum diselenide

    arxiv:2201.10615, February 1, 2022

    Lennart Klebl, Qiaoling Xu, Ammon Fischer, Lede Xian, M. Claassen, A. Rubio, et al.

  46. Excited-state band structure mapping

    arxiv:2108.07099, February 1, 2022

    M. Puppin, C. W. Nicholson, C. Monney, Y. Deng, R. P. Xian, J. Feldl, et al.

  47. Nature of the bonded-to-atomic transition in liquid silica to TPa pressures

    Journal of Applied Physics, arxiv:2112.04568, February 1, 2022

    Shuai Zhang, M. Morales, Raymond Jeanloz, Marius Millot, S. X. Hu, and Eva Zurek

  48. Nonadiabatic Born Effective Charges in Metals and the Drude Weight

    Physical Review Letters, arxiv:2103.04425, February 1, 2022

    C. Dreyer, Sinisa Coh, and Massimiliano Stengel

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