论文标题

随机堆积的球形纳米颗粒的金属胰蛋白酶复合材料的渗透

Percolation in metal-insulator composites of randomly packed spherocylindrical nanoparticles

论文作者

Pokhrel, Shiva, Waters, Brendon, Felton, Solveig, Huang, Zhi-Feng, Nadgorny, Boris

论文摘要

虽然对经典的渗透性有充分的理解,但探索随机包装或堵塞的结构中的渗透效应少得多。在这里,我们从实验和理论上研究了无序的小球骨辅助的二元复合系统中的电渗透,以识别纳米复合材料的结构(渗透率)和功能性能之间的关系。 Experimentally, we determine the percolation threshold $p_c$ and the conductivity critical exponent $t$ for composites of conducting (CrO$_2$) and insulating (Cr$_2$O$_3$) rodlike nanoparticles that are nominally geometrically identical, yielding $p_c=0.305 \pm 0.026$ and $t=2.52 \pm 0.03$ respectively.通过机械收缩方法和随机步行(de gennes ant)方法的组合来实现仿真和建模,其中电荷扩散与通过Nernst-Einstein关系的系统电导率相关。通过有限尺寸缩放标识的渗透阈值和关键指数与实验值非常吻合。奇怪的是,纵横比为6.5,$ p_c = 0.312 \ pm 0.002 $的球形固定器的计算出的渗透阈值非常接近(在数值误差内),与以前在其他两个不同的无序障碍型球体和简单的Cobic lattice,一个令人惊讶和令人惊讶的结果中发现的其他独特的系统中发现的相关。

While classical percolation is well understood, percolation effects in randomly packed or jammed structures are much less explored. Here we investigate both experimentally and theoretically the electrical percolation in a binary composite system of disordered spherocylinders, to identify the relation between structural (percolation) and functional properties of nanocomposites. Experimentally, we determine the percolation threshold $p_c$ and the conductivity critical exponent $t$ for composites of conducting (CrO$_2$) and insulating (Cr$_2$O$_3$) rodlike nanoparticles that are nominally geometrically identical, yielding $p_c=0.305 \pm 0.026$ and $t=2.52 \pm 0.03$ respectively. Simulations and modeling are implemented through a combination of the mechanical contraction method and a variant of random walk (de Gennes ant) approach, in which charge diffusion is correlated with the system conductivity via the Nernst-Einstein relation. The percolation threshold and critical exponents identified through finite size scaling are in good agreement with the experimental values. Curiously, the calculated percolation threshold for spherocylinders with an aspect ratio of 6.5, $p_c=0.312 \pm 0.002$, is very close (within numerical errors) to the one found previously in two other distinct systems of disordered jammed spheres and simple cubic lattice, an intriguing and surprising result.

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