Time-dependent friction and solvation time correlation function

被引:3
|
作者
Samanta, A [1 ]
Ali, SM
Ghosh, SK
机构
[1] Bhabha Atom Res Ctr, Chem Grp, RC & CD Div, Theoret Chem Sect, Bombay 400085, Maharashtra, India
[2] Bhabha Atom Res Ctr, Div Chem Engn, Bombay 400085, Maharashtra, India
来源
NEW JOURNAL OF PHYSICS | 2005年 / 7卷
关键词
D O I
10.1088/1367-2630/7/1/027
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
We have derived a new relation between the time-dependent friction and solvation time correlation function (STCF) for non-polar fluids. The friction values calculated using this relation and simulation results on STCF for a Lennard-Jones fluid are shown to have excellent agreement with the same obtained through mode-coupling theory. Also derived is a relation between the time-dependent dielectric friction and STCF for polar fluids. Routes are thus provided to obtain the time-dependent friction (non-polar as well as dielectric) from an experimentally measured quantity like STCF, even if the interparticle interaction potential is not known.
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