Thermodynamics of glasses: a first principles computation

Citation
M. Mezard et G. Parisi, Thermodynamics of glasses: a first principles computation, J PHYS-COND, 11(10A), 1999, pp. A157-A165
Citations number
40
Categorie Soggetti
Apllied Physucs/Condensed Matter/Materiales Science
Journal title
JOURNAL OF PHYSICS-CONDENSED MATTER
ISSN journal
09538984 → ACNP
Volume
11
Issue
10A
Year of publication
1999
Pages
A157 - A165
Database
ISI
SICI code
0953-8984(19990315)11:10A<A157:TOGAFP>2.0.ZU;2-2
Abstract
We propose a first principles computation of the thermodynamics of simple f ragile glasses starting from the two-body interatomic potential. A replica formulation translates this problem into that of a gas of interacting molec ules, each molecule being build of m atoms, and having a gyration radius (r elated to the cage size) which vanishes at zero temperature. We use a small cage expansion, valid at low temperatures, which allows us to compute the cage size, the specific heat (which follows the Dulong-Petit law) and the c onfigurational entropy.