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A Piston-Rotaxane with Two Potential Stripes: Force Transitions and Yield Stresses

机译:具有两个潜在条纹的活塞轮烷:力转变和屈服应力

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摘要

We examine a rod piston-rotaxane system, where the positions of several mobile rings on the axle are controlled by an external force acting on one of the rings. This allows us to access the translational entropy of the rings. For a simple rotaxane molecule with an axle that has uniform ring-axle interactions along its length, the molecule behaves like a miniature piston filled with a one-dimensional ideal gas. We then examine the effect of two stripes on the axle, having different ring-axle interactions with the mobile rings, so that one section is of high energy (repulsive) for the rings and another section is of lower energy (or attractive). This kind of rotaxane can exhibit rapid changes in displacement or force, and in particular, this molecule can exhibit a yield stress in which the piston suddenly compresses under a small increase in the applied force.
机译:我们研究了杆式活塞-轮烷系统,其中,轴上几个活动环的位置由作用在其中一个环上的外力控制。这使我们可以访问环的平移熵。对于一个简单的轮烷分子,其轴沿其长度方向具有均匀的环-轴相互作用,该分子的行为就像充满一维理想气体的微型活塞。然后,我们检查轴上的两个条纹的效果,这些条纹与活动环的环-轴相互作用不同,因此,一个环对于环来说具有高能量(排斥),而另一环则具有更低的能量(或有吸引力)。这种轮烷可以表现出位移或作用力的快速变化,特别是,该分子可以表现出屈服应力,其中在施加的力的微小增加下活塞突然压缩。

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