Parisi Giorgio, Zamponi Francesco
Dipartimento di Fisica, Università di Roma La Sapienza, Roma, Italy.
J Chem Phys. 2005 Oct 8;123(14):144501. doi: 10.1063/1.2041507.
We use the replica method to study the ideal glass transition of a liquid of identical hard spheres. We obtain estimates of the configurational entropy in the liquid phase, of the Kauzmann packing fraction phi(K), in the range of 0.58-0.62, and of the random close packing density phi(c), in the range of 0.64-0.67, depending on the approximation we use for the equation of state of the liquid. We also compute the pair-correlation function in the glassy states (i.e., dense amorphous packings) and we find that the mean coordination number at phi(c) is equal to 6. All these results compare well with numerical simulations and with other existing theories.
我们使用复制方法来研究相同硬球液体的理想玻璃化转变。我们获得了液相中构型熵的估计值、考兹曼堆积分数$\phi(K)$(范围在0.58 - 0.62)以及随机密堆积密度$\phi(c)$(范围在0.64 - 0.67),这取决于我们对液体状态方程所使用的近似。我们还计算了玻璃态(即致密无定形堆积)中的对关联函数,并且发现$\phi(c)$处的平均配位数等于6。所有这些结果与数值模拟以及其他现有理论都吻合得很好。