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How to predict the ideal glass transition density in polydisperse hard-sphere packings

机译:如何预测多分散硬球填料中的理想玻璃化转变密度

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The formula for the entropy s of the accessible volume of the phase space for frictionless hard spheres is combined with the Boublik-Mansoori-Carnahan-Starling-Leland (BMCSL) equation of state for polydisperse three-dimensional packings to obtain an analytical expression for s as a function of packing density phi. Polydisperse hard-sphere packings with log-normal, Gaussian, and Pareto particle diameter distributions are generated to estimate their ideal glass transition densities phi(g). The accessible entropy s at phi(g) is almost the same for all investigated particle diameter distributions. We denote this entropy as s(g) and can predict phi(g) for an arbitrary particle diameter distribution through an equation s(phi) = s(g). If the BMCSL equation of state is used for s(phi), then phi(g) is found to depend only on the first three moments of a particle diameter distribution. (C) 2015 AIP Publishing LLC.
机译:无摩擦硬球相空间可及体积的熵s公式与多分散三维填料的Boublik-Mansoori-Carnahan-Starling-Leland(BMCSL)状态方程组合,以获得s的解析表达式。作为堆积密度phi的函数。产生具有对数正态,高斯和帕累托粒径分布的多分散硬球填料,以估计其理想的玻璃化转变密度phi(g)。对于所有研究的粒径分布,在phi(g)处的可访问熵s几乎相同。我们将此熵表示为s(g),并且可以通过方程s(phi)= s(g)预测任意粒径分布的phi(g)。如果将BMCSL状态方程用于s(phi),则发现phi(g)仅取决于粒径分布的前三个矩。 (C)2015 AIP Publishing LLC。

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