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    Phase transition and superionization of ice under electric and pressure fields

    Jiachang Zhang1, Haixu Cui2, Hairui Ding1, Jian Sun3, and Xiao Dong1,*

    • 1Key Laboratory of Weak-Light Nonlinear Photonics, School of Physics, Nankai University, Tianjin 300071, China
    • 2College of Physics and Materials Science, Tianjin Normal University, Tianjin 300387, China
    • 3School of Physics and Collaborative Innovation Center of Advanced Microstructures, National Laboratory of Solid State Microstructures, Nanjing University, Nanjing 210093, China

    • *Contact author: xiao.dong@nankai.edu.cn

    Phys. Rev. B 114, 084101 – Published 3 August, 2026

    DOI: https://doi.org/10.1103/wrk2-qfrj

    Abstract

    The phase transition of ice under temperature and pressure fields attracts a great deal of attention from scientific research. However, there are many research gaps on more multiple extreme fields on ice phase transition. Here, using nonequilibrium ab initio molecular dynamics (AIMD), we systematically studied the effects of electric field, pressure, and temperature acting on the ice, and discussed the phase transition reduced by the combination of these extreme fields. Specifically, a phase, absent in zero electric field and named ice VIII′ in this paper, is discovered by applying an electric field to ice VIII, ice VII, and ice X, with high a possibility to be obtained in the laboratory. Later when the electric field further strengthens, superionization occurs as a unidirectional electrical breakdown with detailed analysis of the electric field intensity and ionic conductivity at these extreme multiple fields.

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