Structural relaxation in quantum supercooled liquids: A mode-coupling approach

被引:2
|
作者
Das, Ankita [1 ]
Rabani, Eran [2 ,3 ,4 ]
Miyazaki, Kunimasa [5 ]
Harbola, Upendra [1 ]
机构
[1] Indian Inst Sci, Inorgan & Phys Chem, Bangalore 560012, Karnataka, India
[2] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA
[3] Lawrence Berkeley Natl Lab, Mat Sci Div, Berkeley, CA 94720 USA
[4] Tel Aviv Univ, Sackler Ctr Computat Mol & Mat Sci, IL-69978 Tel Aviv, Israel
[5] Nagoya Univ, Dept Phys, Nagoya, Aichi 4648602, Japan
来源
JOURNAL OF CHEMICAL PHYSICS | 2021年 / 154卷 / 01期
基金
日本学术振兴会;
关键词
FLUCTUATING NONLINEAR HYDRODYNAMICS; GLASS-TRANSITION; HEAT;
D O I
10.1063/5.0032085
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We study supercooled dynamics in a quantum hard-sphere liquid using quantum mode-coupling formulation. In the moderate quantum regime, classical cage effects lead to slower dynamics compared to the strongly quantum regime, where tunneling overcomes classical caging, leading to faster relaxation. As a result, the glass transition critical density can become significantly higher than for the classical liquids. A perturbative approach is used to solve time dependent quantum mode-coupling equations to study in detail the dynamics of the supercooled liquid in the moderate quantum regime. Similar to the classical case, the relaxation time shows the power-law increase with the increase in the density in the supercooled regime. However, the power-law exponent is found to be dependent on the quantumness; it increases linearly as the quantumness is increased in the moderate quantum regime.
引用
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页数:8
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