Negative tails in the velocity correlation function of supercooled liquids

被引:3
|
作者
De Santis, A
Ercoli, A
Rocca, D
机构
[1] Univ Tuscia, DISA, Fac Agraria, I-01100 Viterbo, Italy
[2] Univ Tuscia, INFM Viterbo, I-01100 Viterbo, Italy
[3] Univ Roma La Sapienza, Dipartimento Fis, I-00185 Rome, Italy
[4] Univ Roma La Sapienza, INFM Roma 1, I-00185 Rome, Italy
来源
JOURNAL OF CHEMICAL PHYSICS | 2003年 / 119卷 / 18期
关键词
D O I
10.1063/1.1616514
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
The dynamics of supercooled liquid argon is investigated via a specific correlation function DeltaB. Its time behavior is well reproduced by taking into account the separate contributions of an Enskog-type diffusive part and of damped oscillations of vanishing time integral (nondiffusive part). The implications on the velocity correlation function (VCF) are investigated. Phononlike oscillations, also present in the crystal, can explain the first negative lobe and the subsequent shoulder of the VCF. The slow decay of DeltaB after the fast dynamics (t<1 ps) characterizes the liquid state, and produces negative VCF tails at long times (up to about 5 ps). (C) 2003 American Institute of Physics.
引用
收藏
页码:9661 / 9666
页数:6
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