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关于液体在低能量下态密度的温度依赖性

On the temperature dependence of the density of states of liquids at low energies.

作者信息

Jin Sha, Fan Xue, Stamper Caleb, Mole Richard A, Yu Yuanxi, Hong Liang, Yu Dehong, Baggioli Matteo

机构信息

School of Physics and Astronomy, Shanghai Jiao Tong University, Shanghai, 200240, China.

Wilczek Quantum Center, Shanghai Jiao Tong University, Shanghai, 200240, China.

出版信息

Sci Rep. 2024 Aug 13;14(1):18805. doi: 10.1038/s41598-024-69504-2.

Abstract

We report neutron-scattering measurements of the density of states (DOS) of water and liquid Fomblin in a wide range of temperatures. In the liquid phase, we confirm the presence of a universal low-energy linear scaling of the experimental DOS as a function of the frequency, , which persists at all temperatures. The low-frequency scaling of the DOS exhibits a sharp jump at the melting point of water, below which the standard Debye's law, , is recovered. On the contrary, in Fomblin, we observe a continuous transition between the two exponents reflecting its glassy dynamics, which is confirmed by structure measurements. More importantly, in both systems, we find that the slope a(T) grows with temperature following an exponential Arrhenius-like form, . We confirm this experimental trend using molecular dynamics simulations and show that the prediction of instantaneous normal mode (INM) theory for a(T) is in qualitative agreement with the experimental data.

摘要

我们报告了在很宽温度范围内水和液态氟油膜状态密度(DOS)的中子散射测量结果。在液相中,我们证实了实验测得的DOS存在普遍的低能线性标度关系,即作为频率(\omega)的函数,这种关系在所有温度下都存在。DOS的低频标度在水的熔点处呈现出急剧跃变,低于该熔点时,恢复到标准德拜定律(D(\omega))。相反,在氟油膜中,我们观察到反映其玻璃态动力学的两个指数之间的连续转变,这一点通过结构测量得到了证实。更重要的是,在这两个体系中,我们发现斜率(a(T))随温度按照指数类阿仑尼乌斯形式(a(T)=a_0e^{T_0/T})增长。我们使用分子动力学模拟证实了这一实验趋势,并表明瞬时简正模式(INM)理论对(a(T))的预测与实验数据在定性上相符。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f7cb/11322638/73aad0210530/41598_2024_69504_Fig1_HTML.jpg

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