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Crossover between the Thermodynamic and Nonequilibrium Scenarios of Structural Transformations of H_2O Ih Ice during Compression

机译:H_2O Ih冰压缩过程中结构转变的热力学和非平衡态的交叉

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摘要

A Detailed investigation of different scenarios of structural transformations of H_2O Ih ice during compression to a pressure of 2 GPa in the temperature range from 77 to 200 K is performed. In the range of temperatures and pressures being treated, detailed data are obtained for the density and the shear modulus for different phases of ice including the hda, IX, and XII phases. The experimentally obtained correlations for the density and ultrasonic velocities, with due regard for the available data of structural investigations, are used to identify the transformation sequences Ih → hda (below 135 K), Ih → II → VI (above 165 K), and Ih → IX → VI (from 155 to 180 K). In the vicinity of the crystallization temperature of amorphous ice, i.e., at about 140 K, an anomalous transformation pattern is observed, which is interpreted as predominantly the Ih → XII phase transition. The temperature crossover is discussed between the mode of solid-phase amorphization (Ih → hda) and crystal-crystal transitions, as well as the metastable nature of IX ice and the mechanism of solid-phase amorphization.
机译:在77至200 K的温度范围内,压缩至2 GPa压力期间,H_2O Ih冰的结构转变的不同方案进行了详细研究。在要处理的温度和压力范围内,可以获得有关冰的不同相(包括hda,IX和XII相)的密度和剪切模量的详细数据。在适当考虑结构研究数据的情况下,通过实验获得的密度和超声波速度相关性,可用于识别转化序列Ih→hda(低于135 K),Ih→II→VI(高于165 K)和Ih→IX→VI(从155到180 K)。在无定形冰的结晶温度附近,即在约140K,观察到反常的转变模式,这主要解释为Ih→XII相变。讨论了固相非晶化的模式(Ih→hda)与晶体-晶体转变之间的温度交叉,以及IX冰的亚稳态性质和固相非晶化的机理。

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