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Main Authors: Ackland, Graeme J, Hermann, Andreas, Komatsu, Kazuki, Yamashita, Keishiro, Loveday, J. S.
Format: Preprint
Published: 2025
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Online Access:https://arxiv.org/abs/2504.06244
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author Ackland, Graeme J
Hermann, Andreas
Komatsu, Kazuki
Yamashita, Keishiro
Loveday, J. S.
author_facet Ackland, Graeme J
Hermann, Andreas
Komatsu, Kazuki
Yamashita, Keishiro
Loveday, J. S.
contents Ice phases VII, VIII and X are all based on a body-centered cubic arrangement of molecules, the differences coming from molecular orientation. There is some debate as to whether these should even be considered distinct phases. The standard definition of a transition between distinct phases involves a discontinuity in any derivative of the free energy. This can be hard to prove experimentally, and most previous theoretical works have been based on models which either have continuously differentiable free energies, or no straightforward way to determine the free energy. Here we build a free energy model based on the common definitions of the phases ; ordered ice-VIII, orientationally disordered ice VII and proton-disordered ice X. All transitions in this model might or might not be associated with a discontinuity in the specific heat, depending on paramaterization. By comparing with data, we find that a VII-X transition line exists, but it ends in a critical point hidden within the stability field of phase VIII. If the model is correct, there is a discontinuity between VII and X, so they are separate phases. We propose that the hidden phase boundary might be demonstrated experimentally by compression of supercooled ice VII.
format Preprint
id arxiv_https___arxiv_org_abs_2504_06244
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle The distinction between Ice phases VII, VIII and X
Ackland, Graeme J
Hermann, Andreas
Komatsu, Kazuki
Yamashita, Keishiro
Loveday, J. S.
Statistical Mechanics
Materials Science
Ice phases VII, VIII and X are all based on a body-centered cubic arrangement of molecules, the differences coming from molecular orientation. There is some debate as to whether these should even be considered distinct phases. The standard definition of a transition between distinct phases involves a discontinuity in any derivative of the free energy. This can be hard to prove experimentally, and most previous theoretical works have been based on models which either have continuously differentiable free energies, or no straightforward way to determine the free energy. Here we build a free energy model based on the common definitions of the phases ; ordered ice-VIII, orientationally disordered ice VII and proton-disordered ice X. All transitions in this model might or might not be associated with a discontinuity in the specific heat, depending on paramaterization. By comparing with data, we find that a VII-X transition line exists, but it ends in a critical point hidden within the stability field of phase VIII. If the model is correct, there is a discontinuity between VII and X, so they are separate phases. We propose that the hidden phase boundary might be demonstrated experimentally by compression of supercooled ice VII.
title The distinction between Ice phases VII, VIII and X
topic Statistical Mechanics
Materials Science
url https://arxiv.org/abs/2504.06244