Brownian Dynamics simulation of hard-sphere colloidal dispersions

被引:154
作者
Foss, DR [1 ]
Brady, JF [1 ]
机构
[1] CALTECH, Div Chem & Chem Engn, Pasadena, CA 91125 USA
关键词
D O I
10.1122/1.551104
中图分类号
O3 [力学];
学科分类号
08 ; 0801 ;
摘要
The rheology of hard-sphere suspensions in the absence of hydrodynamic interactions is examined by Brownian Dynamics. Simulations are performed over a wide range of volume fraction phi and Peclet number Pe = (gamma) over dota(2)/D, where (gamma) over dot is the shear rate and D = kT/6 pi eta a is the Stokes-Einstein diffusivity of an isolated spherical particle of radius a and thermal energy kT in a fluid of viscosity eta. At low Pe, the viscosity decreases as Pe increases-the suspension shear thins. The first normal stress difference is positive, while the second normal stress difference is negative. Each normal stress difference vanishes at very low Pe and increases in magnitude to an extremum at Pe approximate to 3. The suspension pressure is proportional to kT and is found to grow as Pe(2) from its equilibrium value. Long-time self-diffusivities scale as D and grow as Pe is increased in this regime. At Pe approximate to 100, the suspension undergoes a disorder-order transition to a microstructure of hexagonally packed strings aligned in the flow direction, which is accompanied by precipitous drops in the viscosity, pressure and long-time self diffusivities. At high Pe, all components of the stress tensor scale as eta(gamma) over dot and the diffusivities scale as (gamma) over dota(2). Viscosity data for a wide range of phi and Pe are collapsed using scaling theories. (C) 2000 The Society of Rheology. [S0148-6055(00)00403-X].
引用
收藏
页码:629 / 651
页数:23
相关论文
共 38 条
[31]   BROWNIAN DIFFUSION IN CONCENTRATED SUSPENSIONS OF INTERACTING PARTICLES [J].
RALLISON, JM .
JOURNAL OF FLUID MECHANICS, 1988, 186 :471-500
[32]   Rheology, self-diffusion, and microstructure of charged colloids under simple shear by massively parallel nonequilibrium Brownian dynamics [J].
Rastogi, SR ;
Wagner, NJ ;
Lustig, SR .
JOURNAL OF CHEMICAL PHYSICS, 1996, 104 (22) :9234-9248
[33]   Computer simulations of dense hard-sphere systems [J].
Rintoul, MD ;
Torquato, S .
JOURNAL OF CHEMICAL PHYSICS, 1996, 105 (20) :9258-9265
[34]   BROWNIAN DYNAMICS SIMULATIONS OF COLLOIDAL HARD-SPHERES - EFFECTS OF SAMPLE DIMENSIONALITY OF SELF-DIFFUSION [J].
SCHAERTL, W ;
SILLESCU, H .
JOURNAL OF STATISTICAL PHYSICS, 1994, 74 (3-4) :687-703
[35]   Brownian dynamics simulation of a hard-sphere suspension [J].
Strating, P .
PHYSICAL REVIEW E, 1999, 59 (02) :2175-2187
[36]   Viscosity of colloidal suspensions [J].
Verberg, R ;
deSchepper, IM ;
Cohen, EGD .
PHYSICAL REVIEW E, 1997, 55 (03) :3143-3158
[37]  
VICIC M, 1999, THESIS CALTECH
[38]   SHEAR-INDUCED ALIGNMENT OF COLLOIDAL PARTICLES IN THE PRESENCE OF A SHEAR-FLOW [J].
XUE, WG ;
GREST, GS .
PHYSICAL REVIEW LETTERS, 1990, 64 (04) :419-422