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Related papers: Polymorphism of superionic ice

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Knowing the phase transformations in dense water ice is key to unraveling the peculiar geophysical properties of Uranus and Neptune, whose stratified interior models predict a thick ice layer beneath a convective ionic fluid layer. In the…

Using density functional molecular dynamics free energy calculations, we show that the body-centered-cubic phase of superionic ice previously believed to be the only phase is in fact thermodynamically unstable compared to a novel phase with…

Earth and Planetary Astrophysics · Physics 2015-06-12 Hugh F. Wilson , Michael L. Wong , Burkhard Militzer

High-pressure experiments using diamond anvils have revealed novel properties and phase behavior of H2O under extreme conditions. When contained in diamond-anvil cells, the H2O samples are usually in direct contact with the diamond anvil.…

Materials Science · Physics 2026-03-19 Pengfei Hou , Yumiao Tian , Zifeng Liu , Junwen Duan , Hanyu Liu , Xing Meng , Russell J. Hemley , Yanming Ma

Using density functional molecular dynamics simulations, we study the behavior of different hydrogen-oxygen compounds at megabar pressures and several thousands of degrees Kelvin where water has been predicted to occur in superionic form.…

Materials Science · Physics 2018-08-01 Burkhard Militzer , Shuai Zhang

The ice giant planets Uranus and Neptune are assumed to contain large amounts of planetary ices such as water, methane, and ammonia. The properties of mixtures of such ices at the extreme pressures and temperatures of planetary interiors…

Earth and Planetary Astrophysics · Physics 2024-10-24 Kyla de Villa , Felipe Gonzalez-Cataldo , Burkhard Militzer

Most water in the universe may be superionic, and its thermodynamic and transport properties are crucial for planetary science but difficult to probe experimentally or theoretically. We use machine learning and free energy methods to…

Computational Physics · Physics 2021-11-24 Bingqing Cheng , Mandy Bethkenhagen , Chris J. Pickard , Sebastien Hamel

Weck et al. (1) report on the existence and stability fields of two superionic (SI) phases of H2O ice at high P-T (P-T) conditions, which has been a topic of static and dynamic experiments and theoretical calculations (see Ref. (2) and…

Materials Science · Physics 2023-08-09 Alexander F. Goncharov , Vitali B. Prakapenka

We present a measurement of H2O ice crystallinity on the surface of trans-neptunian objects (TNOs) with near-infrared narrow-band imaging. The newly developed photometric technique allows us to efficiently determine the strength of an…

Earth and Planetary Astrophysics · Physics 2016-08-17 Tsuyoshi Terai , Yoichi Itoh , Yumiko Oasa , Reiko Furusho , Junichi Watanabe

Superionic states are phases of matters that can simultaneously exhibit some of the properties of a fluid and of a solid. Superionic states of ice, H$_{3}$O, He-H$_{2}$O or He-NH$_{3}$ compounds have been reported in previous works.…

Materials Science · Physics 2020-11-24 Tianxiao Liang , Zihan Zhang , Hongyu Yu , Tian Cui , Chris J. Pickard , Defang Duan

Polyhydrides have been shown to form novel structures at high pressure, which may be found in the interiors of giant planets. With density functional molecular dynamics simulations we studied the behavior of ammonium polyhydride compounds…

Materials Science · Physics 2025-12-01 Kyla de Villa , Xiaoyu Wang , Eva Zurek , Burkkhard Militzer

Aptly named, ice giants such as Uranus and Neptune contain significant amounts of water. While this water cannot be present near the cloud tops, it must be abundant in the deep interior. We investigate the likelihood of a liquid water ocean…

Astrophysics · Physics 2009-11-11 Sloane J. Wiktorowicz , Andrew P. Ingersoll

The most abundant type of planet discovered in the Galaxy has no analogue in our Solar System and is believed to consist of a rocky interior with an overlying thick H2 dominated envelope. Models have predicted that the reaction between the…

Superionic ice, where water molecules dissociate into a lattice of oxygen ions and a rapidly diffusing 'gas' of protons, represents an exotic state of matter with broad implications for planetary interiors and energy applications. Recently,…

The ever-expanding catalog of detected super-Earths calls for theoretical studies of their properties in the case of a substantial water layer. This work considers such water planets with a range of masses and water mass fractions (2 to 5…

Earth and Planetary Astrophysics · Physics 2015-05-18 Roger Fu , Richard J. OConnell , Dimitar D. Sasselov

Water (H2O) ice is ubiquitous component of the universe, having been detected in a variety of interstellar and Solar System environments where radiation plays an important role in its physico-chemical transformations. Although the radiation…

Ab initio free energy calculations are employed to derive the entropy of liquid and superionic water over a wide range of conditions in the interiors of Uranus and Neptune. The resulting adiabats are much shallower in pressure-temperature…

Earth and Planetary Astrophysics · Physics 2025-08-26 Burkhard Militzer

Water and hydrogen at high pressure make up a substantial fraction of the interiors of giant planets. Using ab initio random structure search methods we investigate the ground-state crystal structures of water, hydrogen, and hydrogen-oxygen…

Materials Science · Physics 2013-02-01 Shuai Zhang , Hugh Wilson , Kevin Driver , Burkhard Militzer

Recently there has been tremendous increase in the number of identified extra-solar planetary systems. Our understanding of their formation is tied to exoplanet internal structure models, which rely upon equations of state of light elements…

Earth and Planetary Astrophysics · Physics 2015-06-03 M. D. Knudson , M. P. Desjarlais , R. W. Lemke , T. R. Mattsson , M. French , N. Nettelmann , R. Redmer

Ammonia is predicted to be one of the major components in the depths of the ice giant planets Uranus and Neptune. Their dynamics, evolution, and interior structure are insufficiently understood and models rely imperatively on data for…

Earth and Planetary Astrophysics · Physics 2021-01-19 A. Ravasio , M. Bethkenhagen , J. -A. Hernandez , A. Benuzzi-Mounaix , F. Datchi , M. French , M. Guarguaglini , F. Lefevre , S. Ninet , R. Redmer , T. Vinci
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