Export citation

Export citation

Choose format for download:

Download Citation

    Coexistence of ferroelectricity and ferromagnetism in vanadium-doped HfO2

    Vincenzo Fiorentini1,2, Paola Alippi3, and Gianaurelio Cuniberti2

    Phys. Rev. Materials 9, 114415 – Published 19 November, 2025

    DOI: https://doi.org/10.1103/3zqc-1gvy

    Abstract

    Ab initio density-functional calculations show that orthorhombic Pca21 hafnia HfO2 mixed with vanadium at low concentration is a ferroelectric and ferromagnetic insulator. The multiorbital degeneracy of singly-occupied V states in the nominally 4+ ionic state is broken by magnetism, reduced symmetry, and local distortion, causing a single one-electron majority state per V atom to be occupied. A gap of order 1 eV thus survives at all V concentrations, and intrinsic polarization is preserved at the level of 60–70% of the undoped-HfO2 value. Magnetization is found to increase linearly with V content, with values of 30–40 emu/cm3 at concentrations near the end of the stability range (∼16% V).

    Physics Subject Headings (PhySH)

    Authorization Required

    We need you to provide your credentials before accessing this content.

    References (Subscription Required)

    Outline

    Information

    Sign In to Your Journals Account

    Filter

    Filter

    Article Lookup

    Enter a citation