Abstract
We propose a first-principle computation of the equilibrium thermodynamics of simple fragile glasses starting from the two-body interatomic potential. A replica formulation translates this problem into that of a gas of interacting molecules, each molecule being built of m atoms, and having a gyration radius (related to the cage size) which vanishes at zero temperature. We use a small cage expansion, valid at low temperatures, which allows to compute the cage size, the specific heat (which follows the Dulong and Petit law), and the configurational entropy.
| Original language | English |
|---|---|
| Pages (from-to) | 1076-1095 |
| Number of pages | 20 |
| Journal | Journal of Chemical Physics |
| Volume | 111 |
| Issue number | 3 |
| DOIs | |
| State | Published - 15 Jul 1999 |
| Externally published | Yes |
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