论文标题

剪切二进制Lennard-Jones玻璃中的异源:瞬态响应

Isomorphs in sheared binary Lennard-Jones glass: Transient response

论文作者

Jiang, Yonglun, Weeks, Eric R., Bailey, Nicholas P.

论文摘要

我们已经研究了二进制Lennard-Jones玻璃的剪切变形,以研究应力应变曲线的瞬态部分在热力学状态点沿同构变化时不变的程度。在稳定性的玻璃样品(由冷却速率确定,并以变化的应变速率)上,在玻璃深处的状态点以不同的应变速率确定。密度变化直至和超过两个因子。我们研究了几种产生异源的方法,但是鉴于较大的密度变化和非平衡情况,先前开发的方法都无法产生足够精确的异构。取而代之的是,选择这些较高密度的温度通过要求同构状态点的稳态流动应力在降低单位中不变,以使状态点同构对起点。与稳态流动应力相反,我们发现应力应变曲线上的峰值应力并非不变。尽管差异随密度的增加而减少,但每10%的密度增加,峰值应力减少了几%。瞬态期间应变谱和非植物运动的分析表明,峰值应力变化的根源是形成剪切带的不同趋势,其趋势最高的趋势在最低的密度下发生。我们认为这反映了潜力的有效陡峭。更高的有效陡度会更大的趋势形成剪切带。

We have studied shear deformation of binary Lennard-Jones glasses to investigate the extent to which the transient part of the stress strain curves is invariant when the thermodynamic state point is varied along an isomorph. Shear deformations were carried out on glass samples of varying stability, determined by cooling rate, and at varying strain rates, at a state point deep in the glass. Density changes up to and exceeding a factor of two were made. We investigated several different methods for generating isomorphs but none of the previously developed methods could generate sufficiently precise isomorphs given the large density changes and non-equilibrium situation. Instead, the temperatures for these higher densities were chosen to give state points isomorphic to the starting state point by requiring the steady state flow stress for isomorphic state points to be invariant in reduced units. In contrast to the steady state flow stress, we find that the peak stress on the stress strain curve is not invariant. The peak stress decreases by a few percent for each ten percent increase in density, although the differences decrease with increasing density. Analysis of strain profiles and non-affine motion during the transient phase suggests that the root of the changes in peak stress is a varying tendency to form shear bands, with the largest tendency occurring at the lowest densities. We argue that this reflects the effective steepness of the potential; a higher effective steepness gives a greater tendency to form shear bands.

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