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高压下HO-H和HO-He中对称冰X的晶体结构

Crystal Structure of Symmetric Ice X in HO-H and HO-He under Pressure.

作者信息

Lei Jialin, Lim Jinhyuk, Kim Minseob, Yoo Choong-Shik

机构信息

Institute of Shock Physics and Department of Chemistry, Washington State University, Pullman, Washington 99164, United States.

出版信息

J Phys Chem Lett. 2021 May 20;12(19):4707-4712. doi: 10.1021/acs.jpclett.1c00606. Epub 2021 May 12.

Abstract

Ice VII and ice X are the two most dominant phases, stable over a large pressure range between 2 and 150 GPa and made of fundamentally different chemical bonding. Yet, the two ice phases share a similar bcc-based crystal structure and lattice constants, resulting in a challenge to discern the crystal structure of ice VII and ice X. Here, we present well-resolved X-ray diffraction data of HO in quasi-hydrostatic H and He pressure media, clearly resolving the two ice phases to 130 GPa and the dissociative nature of ice VII to X transition occurring at 20-50 GPa in HO-H and 60-70 GPa in HO-He. The present diffraction data permits, for the first time, the accurate determination of the bulk moduli of 225 (or 228) GPa for ice X and 6.2 (or 4.5) GPa for ice VII, in HO-H (or HO-He), which can provide new constraints for Giant planetary models.

摘要

冰VII和冰X是两个最主要的相,在2至150吉帕的大压力范围内稳定,且由根本不同的化学键组成。然而,这两种冰相具有相似的基于体心立方的晶体结构和晶格常数,这给辨别冰VII和冰X的晶体结构带来了挑战。在此,我们展示了在准静水压氢气和氦气压力介质中HO的高分辨率X射线衍射数据,清晰分辨出这两种冰相至130吉帕,并明确了在HO-H中20 - 50吉帕以及在HO-He中60 - 70吉帕时冰VII向X转变的离解性质。目前的衍射数据首次使得能够准确测定在HO-H(或HO-He)中冰X的体模量为225(或228)吉帕,冰VII的体模量为6.2(或4.5)吉帕,这可为巨行星模型提供新的约束条件。

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