Institute for Experimental and Theoretical Physics, Al-Farabi Kazakh National University, 71 Al-Farabi Avenue, 050040 Almaty, Kazakhstan.
Phys Rev E. 2022 Dec;106(6-2):065203. doi: 10.1103/PhysRevE.106.065203.
The results of modeling shear flows in classical two-dimensional (2D) dipole systems are presented. We used the method of nonequilibrium molecular dynamics to calculate the viscosity at various shear rates. The coefficients of shear viscosity are given in the limit of low shear rates for various regimes of interparticle correlation from a weakly correlated gaseous state to a strongly nonideal liquid state near the crystallization point. The calculations were carried out for bare (unscreened) dipole systems, as well as for dipole systems in a polarizable medium that provide screening of the dipole-dipole interaction. The effect of shear thinning in 2D dipole systems is reported for low values of the coupling parameter. In addition, it is shown that dipole systems can become both less and more viscous due to the presence of a screening medium, depending on the degree of interparticle correlation. The optimal simulation parameters are discussed within the framework of the method of nonequilibrium molecular dynamics for determining the shear viscosity of two-dimensional dipole systems. Moreover, we present a simple fitting curve which provides a universal scaling law for both bare dipole-dipole interaction and screened dipole-dipole interaction.
呈现了经典二维(2D)偶极子体系中切变流的建模结果。我们使用非平衡分子动力学方法计算了在不同剪切速率下的粘度。给出了在从弱关联气态到接近结晶点的强非理想液态的各种粒子间关联区域中,在低剪切速率极限下的剪切粘度系数。计算了裸露(未屏蔽)偶极子体系以及在提供偶极子-偶极子相互作用屏蔽的极化介质中的偶极子体系。对于低耦合参数值,报道了二维偶极子体系中的剪切变稀效应。此外,表明由于屏蔽介质的存在,偶极子体系可以变得更粘或更不粘,这取决于粒子间关联的程度。在非平衡分子动力学方法的框架内讨论了确定二维偶极子体系剪切粘度的最佳模拟参数。此外,我们提出了一个简单的拟合曲线,为裸露偶极子-偶极子相互作用和屏蔽偶极子-偶极子相互作用提供了通用的标度定律。