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首页> 外文期刊>The Journal of Chemical Physics >Fourth virial coefficients of asymmetric nonadditive hard-disk mixtures
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Fourth virial coefficients of asymmetric nonadditive hard-disk mixtures

机译:非对称非加性硬盘混合物的第四病毒系数

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摘要

The fourth virial coefficient of asymmetric nonadditive binary mixtures of hard disks is computed with a standard Monte Carlo method. Wide ranges of size ratio (0.05 q 0.95) and nonadditivity (-0.5 Δ 0.5) are covered. A comparison is made between the numerical results and those that follow from some theoretical developments. The possible use of these data in the derivation of new equations of state for these mixtures is illustrated by considering a rescaled virial expansion truncated to fourth order. The numerical results obtained using this equation of state are compared with Monte Carlo simulation data in the case of a size ratio q 0.7 and two nonadditivities Δ ±0.2.
机译:硬盘的非对称非可加性二元混合物的第四病毒系数采用标准的蒙特卡洛方法进行计算。涵盖了大范围的尺寸比(0.05 q 0.95)和非可加性(-0.5Δ0.5)。数值结果与一些理论发展得出的结果进行了比较。这些数据在推导这些混合物的新状态方程中的可能用途是通过考虑截断为四阶的重新缩放的病毒膨胀来说明的。使用这种状态方程获得的数值结果与尺寸比为q 0.7和两个非相加性Δ±0.2的情况下的Monte Carlo模拟数据进行比较。

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