Scaling behavior of self-diffusion coefficients: Dependence on the mass ratio of a binary mixture

被引:3
|
作者
Bidhoodi, Neeta [1 ]
Das, Shankar P. [1 ]
机构
[1] Jawaharlal Nehru Univ, Sch Phys Sci, New Delhi 110067, India
关键词
MODE-COUPLING THEORY; CLASSICAL STATISTICAL DYNAMICS; GLASS-TRANSITION; SUPERCOOLED LIQUIDS; DENSE FLUIDS; SYSTEMS; FORMULATION; RELAXATION; EQUATION;
D O I
10.1103/PhysRevE.98.032126
中图分类号
O35 [流体力学]; O53 [等离子体物理学];
学科分类号
070204 ; 080103 ; 080704 ;
摘要
In the present work we demonstrate how the diffusion constants D-S for a tagged particle of species s (= 1, 2) of a binary mixture depend on the mass ratio kappa = m(2)/m(1) of the two constituents. This dependence has also been reported earlier from simulations of a mixture. We use here a proper formulation of the self-consistent mode-coupling theory (MCT) of a two-component system. The effects of nonlocal and nonlinear coupling of slowly decaying hydrodynamic fluctuations on the long-time dynamics of a dense mixture is calculated here. The MCT memory functions are estimated here in the adiabatic approximation which assumes for the glassy state fast decay of momentum fluctuations compared to that of the number density. Plots D-1 and D-2 obtained from evaluation of the self-consistent MCT formulas, shows that for nearly equal-sized particles, the two self-diffusion coefficients are related as D-1 similar to D-2(a) with a nonuniversal exponent a and this relation holds over a wide range of kappa values. The simple MCT used here predicts an ideal ergodic-nonergodic transition from liquid to glassy state for critical packings {eta(c)(2), eta(c)(1)} of the two species. For high packing of one species eta(2), at which the mixture is already in a nonergodic state, transition to an ergodic state occurs at a small eta(c)(1) and a reenetry into the nonergodic phase can occur again at an even larger value of eta(c)(1), while eta(2) remains same as before.
引用
收藏
页数:11
相关论文
共 32 条
  • [21] Modeling self-diffusion coefficients of ionic liquids using ePC-SAFT and FVT combined with Einstein relation
    Zuo, Zhida
    Lu, Xiaohua
    Ji, Xiaoyan
    AICHE JOURNAL, 2024, 70 (08)
  • [22] Dependence on the thermodynamic state of self-diffusion of pseudo-hard-sphere and Lennard-Jones potentials
    Marchioni, L.
    Di Muro, M. A.
    Hoyuelos, M.
    PHYSICAL REVIEW E, 2023, 107 (01)
  • [23] Effects of Glycerol Concentrations on Self-diffusion Coefficients of Glycerol in Glycerol-Water-Sodium Chloride Ternary Solutions
    Chen Cong
    Li Weizhong
    Song Yongchen
    Weng Lindong
    Zhang Ning
    ACTA CHIMICA SINICA, 2012, 70 (08) : 1043 - 1046
  • [24] Concentration-dependent self-diffusion coefficients in amorphous Si1-xGex solid solutions: An interdiffusion study
    Noah, Martin A.
    Floetotto, David
    Wang, Zumin
    Mittemeijer, Eric J.
    JOURNAL OF APPLIED PHYSICS, 2015, 117 (16)
  • [25] Turing patterns induced by self-diffusion in a predator-prey model with schooling behavior in predator and prey
    Zhou, Yan
    Yan, Xiang-Ping
    Zhang, Cun-Hua
    NONLINEAR DYNAMICS, 2021, 105 (04) : 3731 - 3747
  • [26] Temperature Dependence of Ion Transport in Dilute Tetrabutylammonium Triflate-Acetate Solutions and Self-Diffusion in Pure Acetate Liquids
    Bopege, Dharshani N.
    Petrowsky, Matt
    Fleshman, Allison M.
    Frech, Roger
    Johnson, Matthew B.
    JOURNAL OF PHYSICAL CHEMISTRY B, 2012, 116 (01) : 71 - 76
  • [27] Microscopic Theory of Long-Time Center-of-Mass Self-Diffusion and Anomalous Transport in Ring Polymer Liquids
    Mei, Baicheng
    Dell, Zachary E.
    Schweizer, Kenneth S.
    MACROMOLECULES, 2020, 53 (23) : 10431 - 10445
  • [28] Piston effect induced by cross-boundary mass diffusion in a binary fluid mixture near its liquid-vapor critical point
    Hu, Zhan-Chao
    Zhang, Xin-Rong
    INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER, 2019, 140 : 691 - 704
  • [29] Implementation of a perturbation model for a dilute binary liquid and comparison of model mass diffusion coefficients with microgravity experiment results for liquid Pb 1 wt % Au
    Scott, Paul J.
    Smith, Reginald W.
    CANADIAN JOURNAL OF PHYSICS, 2009, 87 (08) : 933 - 944
  • [30] Numerical Study of Self-Diffusion Coefficients for H2, O2, CO, and CH4 in Transcritical CO2 with Molecular Dynamics Simulation
    Zhang, Tongjia
    Zhang, Bowei
    Zhang, Jie
    Jin, Hui
    INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2025, 64 (14) : 7587 - 7597