Publications

2020

  • Marcin Raczkowski, Fakher F. Assaad, Masatoshi Imada
    "Local moments versus itinerant antiferromagnetism: Magnetic phase diagram and spectral properties of the anisotropic square lattice Hubbard model"
    Phys. Rev. B 103 (2021) 125137 (1-18). [arXiv:2012.01444] [Phys. Rev. B103.125137]
    DOI:10.1103/PhysRevB.103.125137

  • Yuhki Kohsaka
    "Removing background and estimating a unit height of atomic steps from a scanning probe microscopy image using a statistical model"
    Rev. Sci. Instrum. 92 (2021) 033702 (1-9). [arXiv:2012.01570] [Rev. Sci. Instrum.92.]
    DOI:10.1063/5.0038852

  • Peng Zhang, Ryo Noguchi, Kenta Kuroda, Chun Lin, Kaishu Kawaguchi, Koichiro Yaji, Ayumi Harasawa, Mikk Lippmaa, Simin Nie, Hongming Weng, V. Kandyba, A. Giampietri, A. Barinov, Qiang Li, G. D. Gu, Shik Shin, Takeshi Kondo
    "Observation and control of the weak topological insulator state in ZrTe5"
    Nat. Commun. 12 (2021) 406(1-7). [Nat. Commun.12.]
    DOI:10.1038/s41467-020-20564-8

  • Ryo Noguchi, Masaru Kobayashi, Zhanzhi Jiang, Kenta Kuroda, Takanari Takahashi, Zifan Xu, Daehun Lee, Motoaki Hirayama, Masayuki Ochi, Tetsuroh Shirasawa, Peng Zhang, Chun Lin, Cédric Bareille, Shunsuke Sakuragi, Hiroaki Tanaka, So Kunisada, Kifu Kurokawa, Koichiro Yaji, Ayumi Harasawa, Viktor Kandyba, Alessio Giampietri, Alexei Barinov, Timur K. Kim, Cephise Cacho, Makoto Hashimoto, Donghui Lu, Shik Shin, Ryotaro Arita, Keji Lai, Takao Sasagawa, Takeshi Kondo
    "Evidence for a higher-order topological insulator in a three-dimensional material built from van der Waals stacking of bismuth-halide chains"
    Nat. Mater. 20 (2021) 473-479. [Nat. Mater.20.]
    DOI:10.1038/s41563-020-00871-7

  • Maxime Charlebois and Masatoshi Imada
    "Single-Particle Spectral Function Formulated and Calculated by Variational Monte Carlo Method with Application to d-Wave Superconducting State"
    Physical Review X 10 (2020) 041023(1-14). [arXiv:1912.09960] [PhysRevX.10.041023]
    DOI:10.1103/PhysRevX.10.041023

  • Takahiro Misawa, Kazuyoshi Yoshimi, and Takao Tsumuraya
    "Electronic correlation and geometrical frustration in molecular solids: A systematic ab initio study of beta '-X[Pd(dmit)(2)](2)"
    Phys. Rev. Research 2 (2020) 032072(1-6). [arXiv:2004.00970] [Phys. Rev. Research2.032072]
    DOI:10.1103/PhysRevResearch.2.032072

  • https://arxiv.org/abs/2109.10542

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2021

  • Yusuke Nomura and Ryotaro Arita
    "Superconductivity in infinite-layer nickelates"
    Rep. Prog. Phys. 85 (2022) 052501. [arXiv:2107.12923] [Rep. Prog. Phys.85.052501]
    DOI:10.1088/1361-6633/ac5a60

  • H. Y. Huang, A. Singh, C. I. Wu, C. D. Xie, J. Okamoto, A. A. Belik, E. Kurmaev, A. Fujimori, C. T. Chen, S. V. Streltsov, and D. J. Huang
    "Resonant inelastic x-ray scattering as a probe of Jeff = 1/2 state in 3d transition metal oxides"
    npj Quantum Mater.7 (2022) 33(1-6). [npj Quantum Mater.7.33]
    DOI:10.1038/s41535-022-00430-0

  • Kenta Kuroda, Koichiro Yaji, Ryo Noguchi, Ayumi Harasawa, Shik Shin, Takeshi Kondo, and Fumio Komori
    "Visualization of optical polarization transfer to photoelectron spin vector emitted from a spin-orbit coupled surface state"
    Phys. Rev. B 105 105 (2022) L121106 . [arXiv:/2105.02749] [Phys. Rev. B 105105.L121106 ]
    DOI:10.1103/PhysRevB.105.L121106

  • Hiroaki Tanaka, Shota Okazaki, Kenta Kuroda, Ryo Noguchi, Yosuke Arai, Susumu Minami, Shinichiro Ideta, Kiyohisa Tanaka, Donghui Lu, Makoto Hashimoto, Viktor Kandyba, Mattia Cattelan, Alexei Barinov, Takayuki Muro, Takao Sasagawa, and Takeshi Kondo
    "Large anomalous Hall effect induced by weak ferromagnetism in the noncentrosymmetric antiferromagnet CoNb3S6"
    Phys. Rev. B 105 105 (2022) L121102. [arXiv:2202.09280v1] [Phys. Rev. B 105105.L121102]
    DOI:10.1103/PhysRevB.105.L121102

  • M.-T. Huebsch, Y. Nomura, S. Sakai, and R. Arita
    "Magnetic structures and electronic properties of cubic-pyrochlore ruthenates from first principles"
    J. Phys. : Condens. Matter 34 (2022) 194003 (1-14). [arXiv:2202.00277] [J. Phys.:Condens. Matter34.194003]
    DOI:10.1088/1361-648X/ac513c

  • Ryota Masuki, Takuya Nomoto, Ryotaro Arita, Terumasa Tadano
    "Anharmonic Grüneisen theory based on self-consistent phonon theory: Impact of phonon-phonon interaction neglected in the quasiharmonic theory"
    Phys. Rev. B 105 (2022) 064112 (1-17). [arXiv:2109.10046] [Phys. Rev. B105.064112]
    DOI:10.1103/PhysRevB.105.064112

  • Yuxuan Wan, Lihai Wang, Kenta Kuroda, Peng Zhang, Keisuke Koshiishi, Masahiro Suzuki, Jaewook Kim, Ryo Noguchi, Cédric Bareille, Koichiro Yaji, Ayumi Harasawa, Shik Shin, Sang-Wook Cheong, Atsushi Fujimori, and Takeshi Kondo
    "Selective observation of surface and bulk bands in polar WTe2 by laser-based spin- and angle-resolved photoemission spectroscopy"
    Phys. Rev. B 105 105 (2022) 085421. [arXiv:2110.10944] [Phys. Rev. B 105105.085421]
    DOI:10.1103/PhysRevB.105.085421

  • Motoaki Hirayama, Yusuke Nomura, and Ryotaro Arita
    "Ab Initio Downfolding Based on the GW Approximation for Infinite-Layer Nickelates"
    Front. Phys. 10 (2022) 824144. [arXiv:2202.03661] [Front. Phys.10.824144]
    DOI:10.3389/fphy.2022.824144

  • Y. Arai, Kenta Kuroda, T. Nomoto, Z. H. Tin, S. Sakuragi, C. Bareille, S. Akebi, K. Kurokawa, Y. Kinoshita, W.-L. Zhang, S. Shin, M. Tokunaga, H. Kitazawa, Y. Haga, H. S. Suzuki, S. Miyasaka, S. Tajima, K. Iwasa, R. Arita and Takeshi Kondo
    "Multipole polaron in the devil’s staircase of CeSb"
    Nature Materials 21 (2022) 410-415. [arXiv:2105.11772] [Nature Materials21.410]
    DOI:10.1038/s41563-021-01188-9

  • Kazuyoshi Yoshimi, Takao Tsumuraya, and Takahiro Misawa
    "ab initio derivation and exact-diagonalization analysis of low-energy effective Hamiltonians for β’-X[Pd(dmit)_2]_2"
    Phys. Rev. Research 3 (2021) 043224 (1-11). [arXiv:2109.10542] [Phys. Rev. Research3.043224]
    DOI:10.1103/PhysRevResearch.3.043224

  • K. Hagiwara, M. Ishikado, M. Horio, K. Koshiishi, S. Nakata, S. Ideta, K. Tanaka, K. Horiba, K. Ono, H. Kumigashira, T. Yoshida, S. Ishida, H. Eisaki, S. Shamoto, and A. Fujimori
    "Superconducting gap and pseudogap in the surface states of the iron-based superconductor PrFeAsO1−y studied by angle-resolved photoemission spectroscopy"
    Phys. Rev. Research 3 (2021) 043151 (1-5). [arXiv:2109.12522] [Phys. Rev. Research3.043151]
    DOI:10.1103/PhysRevResearch.3.043151

  • H. Y. Huang, A. Singh, C. Y. Mou, S. Johnston, A. F. Kemper, J. van den Brink, P. J. Chen, T. K. Lee, J. Okamoto, Y. Y. Chu, J. H. Li, S. Komiya, A. C. Komarek, A. Fujimori, C. T. Chen, and D. J. Huang
    "Quantum Fluctuations of Charge Order Induce Phonon Softening in a Superconducting Cuprate"
    Phys. Rev. X 11 (2021) 041038(1-9). [arXiv:2108.11425] [Phys. Rev. X11.041038]
    DOI:10.1103/PhysRevX.11.041038

  • Akira Matsui, Takuya Nomoto, and Ryotaro Arita
    "Skyrmion-size dependence of the topological Hall effect: A real-space calculation"
    Phys. Rev. B 104 (2021) 174432 (1-6)(2021) . [arXiv:2103.12343"] [Phys. Rev. B104.174432]
    DOI:10.1103/PhysRevB.104.174432

  • Ryo Noguchi, Kenta Kuroda, Mitsuaki Kawamura, Koichiro Yaji, Ayumi Harasawa, Takushi Iimori, Shik Shin, Fumio Komori, Taisuke Ozaki, and Takeshi Kondo
    "Scaling law for Rashba-type spin splitting in quantum-well films"
    Phys. Rev. B 104 104 (2021) L180409. [arXiv:2012.11289] [ Phys. Rev. B 104104.L180409]
    DOI:10.1103/PhysRevB.104.L180409

  • S. Ideta, S. Johnston, T. Yoshida, K. Tanaka, M. Mori, H. Anzai, A. Ino, M. Arita, H. Namatame, M. Taniguchi, S. Ishida, K. Takashima, K. M. Kojima, T. P. Devereaux, S. Uchida, and A. Fujimori
    "Hybridization of Bogoliubov Quasiparticles between Adjacent CuO2 Layers in the Triple-Layer Cuprate Bi2Sr2Ca2Cu3O10+δ Studied by Angle-Resolved Photoemission Spectroscopy"
    Phys. Rev. Lett. 127 (2021) 217004 (1-6). [arXiv:2010.15373] [Phys. Rev. Lett. 127.217004]
    DOI:10.1103/PhysRevLett.127.217004

  • Kazuhiro Nawa, Yoshinori Imai, Youhei Yamaji, Hideyuki Fujihara, Wakana Yamada, Ryotaro Takahashi, Takumi Hiraoka, Masato Hagihala, Shuki Torii, Takuya Aoyama, Takamasa Ohashi, Yasuhiro Shimizu, Hirotada Gotou, Masayuki Itoh, Kenya Ohgushi, and Taku J. Sato
    "Strongly Electron-Correlated Semimetal RuI3 with a Layered Honeycomb Structure"
    J. Phys. Soc. Jpn 90 (2021) 123703 (1-5). [arXiv:2109.12864] [J. Phys. Soc. Jpn90.]
    DOI:10.7566/JPSJ.90.123703

  • Youhei Yamaji, Teppei Yoshida, Atsushi Fujimori, and Masatoshi Imada
    "Hidden self-energies as origin of cuprate superconductivity revealed by machine learning"
    Phys. Rev. Research 3 (2021) 043099 (1-37). [arXiv:1903.08060] [Phys.Rev.Research3.043099]
    DOI:10.1103/PhysRevResearch.3.043099

  • S. Nakata, M. Horio, K. Koshiishi, K. Hagiwara, C. Lin, M. Suzuki, S. Ideta, K. Tanaka, D. Song, Y. Yoshida, H. Eisaki, A. Fujimori
    "Nematicity in a cuprate superconductor revealed by angle-resolved photoemission spectroscopy under uniaxial strain"
    npj Quantum Mater.6 (2021) 86 (1-6). [arXiv:1811.10028] [npj Quantum Mater.6.86]
    DOI:10.1038/s41535-021-00390-x

  • Fumihiro Imoto, Masatoshi Imada, and Atsushi Oshiyama
    "Order-N orbital-free density-functional calculations with machine learning of functional derivatives for semiconductors and metals"
    Phys. Rev. Research 3 (2021) 033198(1-17). [arXiv:2109.01501] [PhysRevResearch.3.033198]
    DOI:10.1103/PhysRevResearch.3.033198

  • Maxime Charlebois, Jean-Baptiste Morée, Kazuma Nakamura, Yusuke Nomura, Terumasa Tadano, Yoshihide Yoshimoto, Youhei Yamaji, Takumi Hasegawa, Kazuyuki Matsuhira, and Masatoshi Imada
    "Ab initio derivation of low-energy Hamiltonians for systems with strong spin-orbit interaction: Application to Ca5Ir3O12"
    Phys. Rev. B 104 (2021) 075153(1-19). [arXiv:2103.09539] [PhysRevB.104.075153]
    DOI:10.1103/PhysRevB.104.075153

  • T. Wang, M. Hirayama, T. Nomoto, T. Koretsune, R. Arita, and J. Livas-Flores
    "Absence of conventional room-temperature superconductivity at high pressure in carbon-doped H3S"
    Phys. Rev. B 104 (2021) 064510 (1-6) . [arXiv:2104.03710] [Phys. Rev. B104.064510]
    DOI:10.48550/arXiv.2104.03710

  • Yusuke Nomura and Masatoshi Imada
    "Dirac-type nodal spin liquid revealed by refined quantum many-body solver using neural-network wave function, correlation ratio, and level spectroscopy"
    Phys. Rev. X 11 (2021) 031034(1-19). [arXiv:2005.14142] [PhysRevX.11.031034]
    DOI:10.1103/PhysRevX.11.031034

  • Yusuke Nomura, Nobuyuki Yoshioka, and Franco Nori
    "Purifying Deep Boltzmann Machines for Thermal Quantum States"
    Phys. Rev. Lett. 127 (2021) 060601 (1-7). [arXiv:2103.04791] [Phys.Rev.Lett.127.060601]
    DOI:10.1103/PhysRevLett.127.060601

  • Masatoshi Imada
    "Charge Order and Superconductivity as Competing Brothers in Cuprate High-Tc Superconductors"
    J. Phys. Soc. Jpn. 90 (2021) 111009(1-10). [arXiv:2105.07427][JPSJ.90.111009]
    DOI:10.7566/JPSJ.90.111009

  • Masatoshi Imada
    "Resonant Inelastic X-Ray Scattering Spectra of Cuprate Superconductors Predicted by Model of Fractionalized Fermions"
    J. Phys. Soc. Jpn. 90 (2021) 074702(1-10). [arXiv:2103.10016][JPSJ.90.074702]
    DOI:10.7566/JPSJ.90.074702

  • Y. Matsuzawa, T. Morita, M. Arita, A. Giampietri, V. Kandyba, A. Barinov, A. Takahashi, Y. Nagakubo, T. Adachi, Y. Koike, A. Fujimori, N. L. Saini, and T. Mizokawa,
    "Fermi surface geometry and inhomogeneous electronic states in Pr1.3-xLa0.7CexCuO4(x = 0.05) with small superconducting volume fraction"
    J. Phys. Soc. Jpn 90 (2021) 054704(1-5). [J. Phys. Soc. Jpn90.054704]
    DOI:10.7566/JPSJ.90.054704

  • Chun Lin, Masayuki Ochi, Ryo Noguchi, Kenta Kuroda, Masahito Sakoda, Atsushi Nomura, Masakatsu Tsubota, Peng Zhang, Cedric Bareille, Kifu Kurokawa, Yosuke Arai, Kaishu Kawaguchi, Hiroaki Tanaka, Koichiro Yaji, Ayumi Harasawa, Makoto Hashimoto, Donghui Lu, Shik Shin, Ryotaro Arita, Satoshi Tanda, Takeshi Kondo
    "Visualization of the strain-induced topological phase transition in a quasi-one-dimensional superconductor TaSe3"
    Nat. Mater. 20 (2021) 1093-1099. [arXiv:2009.06353v1] [Nat. Mater.20.]
    DOI:10.1038/s41563-021-01004-4

  • Yusuke Nomura
    "Helping restricted Boltzmann machines with quantum-state representation by restoring symmetry"
    J. Phys.: Condens. Matter 33 (2021) 174003(1-8). [arXiv:2009.14777] [J. Phys.: Condens. Matter 33.174003]
    DOI:10.1088/1361-648X/abe268

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2022

  • Kota Ido, Kazuyoshi Yoshimi, Takahiro Misawa, Masatoshi Imada
    "Unconventional dual 1D-2D quantum spin liquid revealed by ab initio studies on organic solids family"
    npj Quantum Mater. 7 (2022) 48(1-10). [arXiv:2202.07182] [[npj Quantum Mater.7.48]
    DOI:10.1038/s41535-022-00452-8

  • RuQing G. Xu, Tsuyoshi Okubo, Synge Todo, Masatoshi Imada
    "Optimized implementation for calculation and fast-update of Pfaffians installed to the open-source fermionic variational solver mVMC"
    Comput. Phys. Commun. 277 (2022) 108375(1-10). [arXiv:2105.13098v3] [Comput. Phys. Commun.277.108375]
    DOI:10.1016/j.cpc.2022.108375.

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