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    Experimental confirmation of the magnetic ordering transition induced by an electronic structure change in the metallic triangular antiferromagnet Co1/3TaS2

    Han-Jin Noh1,*, En-Jin Cho1, Byeong-Gyu Park2, Hyowon Park3,4,†, Ivar Martin3, Cristian D. Batista5,6, Pyeongjae Park7,8,9, Woonghee Cho7,8, and Je-Geun Park7,8,10

    • *Contact author: ffnhj@jnu.ac.kr
    • †Contact author: hyowon@uic.edu

    Phys. Rev. B 113, 125126 – Published 12 March, 2026

    DOI: https://doi.org/10.1103/x8rf-smft

    Abstract

    We report angle-resolved photoemission spectroscopy (ARPES) studies combined with DFT+DMFT calculations to confirm that the magnetic ordering vector transition from Q=(1/2,0,0) to Q=(1/3,0,0) in the metallic triangular antiferromagnets Co1/3±εTaS2 (ε≈0.007) is induced by the electronic structure change in the system. The ARPES-measured Fermi surface (FS) maps of Co0.325TaS2 show two hexagonal and one circular holelike FSs around Γ, which matches well with the triple-Q state by taking into account the contribution of nesting vectors occurring between Co 3d and Ta 5d orbitals. In the case of Co0.340TaS2, a new electron pocket around K appears, and the FS geometry changes as a result of the correlation effect of Co4S18 tripods forming in the system. The magnetic susceptibility calculations based on the charge-self-consistent DFT+DMFT band structures and the random phase approximation indicate that the most stable magnetic ordering vector (1/2,0,0) split into (1/6,0,0) and (1/2,0,0), which is consistent with the magnetic phase transition around x=1/3 in CoxTaS2.

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