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    Noncentrosymmetric Mott ground state in the breathing kagome lattice Nb3Cl8

    Keyi Li1,2, Xin Han2, Hao Li1,2, Helin Mei1, Mingshu Tan1,2, Bingru Lu1,2, Xiang Li1,2, Wenbo Sang1,2, Xinbo Wang2 et al.

    Anmin Zhang1, Jianting Ji2, Youguo Shi2,*, Feng Jin2,†, and Qingming Zhang1,2,‡

    • *Contact author: ygshi@iphy.ac.cn
    • †Contact author: jinfeng@iphy.ac.cn
    • ‡Contact author: qmzhang@iphy.ac.cn

    Phys. Rev. B 112, 214116 – Published 26 December, 2025

    DOI: https://doi.org/10.1103/9n97-dp2z

    Abstract

    The breathing Kagome material Nb3Cl8 has recently been identified as a single-band Mott insulator and theoretically predicted to host coexisting ferroelectricity, magnetism, and ferrovalley—yet experimental verification of these predictions remains lacking. Here, through polarization- and temperature-dependent Raman and second harmonic generation measurements, we reveal that the low-temperature (LT) phase of this material retains C3 rotational symmetry while breaking inversion symmetry. We propose that the structural phase transition at Ts corresponds to a stacking-order transition: from centrosymmetric AB stacking to noncentrosymmetric AA/BB stacking, driven by enhanced interlayer electric dipole-dipole interactions. With an AA/BB stacking sequence, the LT phase exhibits net electric dipole moments oriented perpendicular to the kagome plane. Our findings provide directly experimental evidence for the existence of a noncentrosymmetric Mott ground state, thereby establishing a unique platform for investigating the interplay between inversion symmetry breaking and strong electron correlation.

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