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    Valley polarization and anomalous valley Hall effect in double-transition-metal MXene HfCr2C2H2

    Longjun Li1, Qianwei Wang1, Mengqiu Long1, Mengqiu Cai2, Yu-Qing Zhao3, Biao Liu1,4,*, and Junliang Yang1,4,5

    • 1Hunan Key Laboratory of Nanophotonics and Devices, School of Physics, Central South University, Changsha, Hunan 410083, People's Republic of China
    • 2School of Physics and Electronics Science, Hunan University, Changsha, Hunan 410082, People's Republic of China
    • 3School of Physics and Electronics Science, Hunan University of Science and Technology, Hunan Provincial Key Laboratory of Intelligent Sensors and New Sensor Materials, Xiangtan 411201, People's Republic of China
    • 4Hunan Key Laboratory for Super-microstructure and Ultrafast Process, School of Physics, Central South University, Changsha, Hunan 410083, People's Republic of China
    • 5State Key Laboratory of Powder Metallurgy, Central South University, Changsha, Hunan 410083, People's Republic of China

    • *Contact author: bliu612@csu.edu.cn

    Phys. Rev. Materials 10, 074411 – Published 20 July, 2026

    DOI: https://doi.org/10.1103/tngd-wf3v

    Abstract

    As a crucial information carrier in condensed matter physics and next-generation information devices, the valley degree of freedom has made the realization of its polarization modulation and effective induction of the anomalous valley Hall effect a core research direction in the field of valleytronics. However, relevant studies on achieving this effect in two-dimensional double-transition-metal MXenes antiferromagnetic systems remain scarce. Based on first-principles calculations, we systematically investigate the valley-related electronic structure and transport properties of double-transition-metal MXene HfCr2C2H2. It is found that the HfCr2C2H2 can lift the valley degeneracy at the edges of the conduction and valence bands, resulting in valley splittings of 63.3 meV and 16.1 meV, respectively. Importantly, the nonzero Berry curvature in the K and K′ valleys, together with the finite anomalous Hall conductivity in the vicinity of the band edges, provides evidence for the anomalous Hall effect in the valley in this material. Furthermore, the valley splitting can be effectively tuned by the magnetization direction and biaxial strain, while the valley polarization can be reversed through manipulation of the magnetization direction. This study provides a new material platform and theoretical basis for the design and development of magnetically controlled valleytronic devices in double-transition-metal MXenes.

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