CCMS

Center for Computational Materials Science
Institute for Materials Research,
Tohoku University

Achievement

    FY2023

  1. Large anomalous Hall effect and unusual domain switching in an orthorhombic antiferromagnetic material NbMnP
    Hisashi Kotegawa, Yoshiki Kuwata, Vu Thi Ngoc Huyen, Yuki Arai, Hideki Tou, Masaaki Matsuda, Keiki Takeda, Hitoshi Sugawara, Michi-To Suzuki
    npj Quantum Mater. 8, 56 (2023)
    [arXiv:2305.02028 (2023)]
  2. Valley polarization dependence of nonreciprocal transport in a chiral semiconductor
    Kenta Sudo, Yuki Yanagi, Takeshi Takahashi, Kim-Khuong Huynh, Katsumi Tanigaki, Kaya Kobayashi, Michi-To Suzuki, and Motoi Kimata
    Phys. Rev. B 108, 125137/1-7(2023)
  3. High-performance descriptor for magnetic materials: Accurate discrimination of magnetic structure
    Michi-To Suzuki, Takuya Nomoto, Eiaki V. Morooka, Yuki Yanagi, and Hiroaki Kusunose
    Phys. Rev. B 108, 014403/1-11 (2023)
    [arXiv:2304.06282 (2023)]
  4. EDITORS' SUGGESTION Spin-Derived Electric Polarization and Chirality Density Inherent in Localized Electron Orbitals
    Shintaro Hoshino, Michi-To Suzuki, and Hiroaki Ikeda
    Phys. Rev. Lett. 130, 256801/1-6(2023)
    [arXiv:2210.02148 (2022)]
  5. Spontaneous topological Hall effect induced by non-coplanar antiferromagnetic order in intercalated van der Waals materials
    H. Takagi, R. Takagi, S. Minami, T. Nomoto, K. Ohishi, Michi-To Suzuki, Y. Yanagi, M. Hirayama, N. D. Khanh, K. Karube, H. Saito, D. Hashizume, R. Kiyanagi, Y. Tokura, R. Arita, T. Nakajima, and S. Seki
    Nature Phys. 19, 961–968 (2023)
  6. Generation of modulated magnetic structures based on cluster multipole expansion: Application to α-Mn and CoM3S6
    Yuki Yanagi, Hiroaki Kusunose, Takuya Nomoto, Ryotaro Arita, and Michi-To Suzuki
    Phys. Rev. B 107, 014407/1-15(2023)
    [arXiv:2201.07361 (2022)]
  7. FY2021

  8. Spin and anomalous Hall effects emerging from topological degeneracy in the Dirac fermion system CuMnAs
    Vu Thi Ngoc Huyen, Yuki Yanagi, and Michi-To Suzuki
    Phys. Rev. B 104, 035110/1-12 (2021)
    [arXiv:2104.13704 (2021)]
  9. First-principles investigation of magnetic and transport properties in hole-doped shandite compounds Co3InxSn2-xS2
    Yuki Yanagi, Junya Ikeda, Kohei Fujiwara, Kentaro Nomura, Atsushi Tsukazaki, and Michi-To Suzuki
    Phys. Rev. B 103, 205112 (2021)
    [arXiv:2011.14567 (2020.11)]
  10. FY2020

  11. Benchmark for Ab Initio Prediction of Magnetic Structures based on Cluster Multipole Theory
    M.-T. Huebsch, T. Nomoto, M.-T. Suzuki, and R. Arita
    Phys. Rev. X 11, 011031 (2021)
    [arXiv:2008.13669v1 (2020.08)]
  12. Microscopic multipole description in condensed matter physics (4)
    S. Hayami, M. Yatsushiro, Y. Yanagi, and H. Kusunose
    SOLID STATE PHYSICS (Japanese journal), 56, 1 (2021)
  13. Physical property analysis of antiferromagnet based on cluster multipole theory and electronic structure calculation
    Michi-To Suzuki, Yuki Yanagi, and Ryotaro Arita
    SOLID STATE PHYSICS (Japanese journal), 55, 561−572 (2020)
  14. Bottom-up design of spin-split and reshaped electronic band structures in antiferromagnets without spin-orbit coupling: Procedure on the basis of augmented multipoles
    Satoru Hayami, Yuki Yanagi, and Hiroaki Kusunose
    Phys. Rev. B 102, 144441 (2020)
    [arXiv:2008.010815 (2020.08)]
  15. Microscopic multipole description in condensed matter physics (3)
    S. Hayami, M. Yatsushiro, Y. Yanagi, and H. Kusunose
    SOLID STATE PHYSICS (Japanese journal), 55, 379 (2020)
  16. Anomalous Hall effect in κ-type organic antiferromagnets
    Makoto Naka, Satoru Hayami, Hiroaki Kusunose, Yuki Yanagi, Yukitoshi Motome, and Hitoshi Seo
    Phys. Rev. B 102, 075112 (2020)
    [arXiv:2004.04578 (2020.04)]
  17. Spontaneous antisymmetric spin splitting in noncollinear antiferromagnets without spin-orbit coupling
    Satoru Hayami, Yuki Yanagi, and Hiroaki Kusunose
    Phys. Rev. B 101, 220403(R) (2020)
    [arXiv:2001.05630 (2020.01)]
  18. FY2019

  19. Microscopic multipole description in condensed matter physics (2)
    S. Hayami, M. Yatsushiro, Y. Yanagi, and H. Kusunose
    SOLID STATE PHYSICS (Japanese journal), 55, 1 (2020)
  20. Momentum-Dependent Spin Splitting by Collinear Antiferromagnetic Ordering
    Satoru Hayami, Yuki Yanagi, and Hiroaki Kusunose
    J. Phys. Soc. Jpn. 88, 123702 (2019)
    [arXiv:1908.08680 (2019.08)]
  21. Spin current generation in organic antiferromagnets
    Makoto Naka, Satoru Hayami, Hiroaki Kusunose, Yuki Yanagi, Yukitoshi Motome, and Hitoshi Seo
    Nat. Commun. 10, 4305 (2019)
    [arXiv:1902.02506 (2019.02)]
  22. Topology analysis for anomalous Hall effect in the noncollinear antiferromagnetic states of Mn3AN (A = Ni, Cu, Zn, Ga, Ge, Pd, In, Sn, Ir, Pt)
    Vu Thi Ngoc Huyen, Michi-To Suzuki, Kunihiko Yamauchi, and Tamio Oguchi
    Phys. Rev. B 100, 094426 (2019)
    [arXiv: 1905.07962 (2019.05)]
  23. Time-reversal symmetry breaking superconductivity in hole-doped monolayer MoS2
    Rikuto Oiwa, Yuki Yanagi, and Hiroaki Kusunose
    J. Phys. Soc. Jpn. 88, 063703 (2019)
    [arXiv:1903.04830 (2019.03)]
  24. EDITORS' SUGGESTION Multipole expansion for magnetic structures: A generation scheme for symmetry-adapted orthonormal basis set in crystallographic point group
    M.-T. Suzuki, T. Nomoto, R. Arita, Y. Yanagi, S. Hayami, and H. Kusunose
    Phys. Rev. B 99,174407 (2019)
    [arXiv:1902.10819 (2019.02)]
  25. FY2018

  26. Microscopic multipole description in condensed matter physics (1)
    S. Hayami, M. Yatsushiro, Y. Yanagi, and H. Kusunose
    SOLID STATE PHYSICS (Japanese journal), 54, 131 (2019)