Lennard-Jones binary mixture: A thermodynamical approach to glass transition

Citation
B. Coluzzi et al., Lennard-Jones binary mixture: A thermodynamical approach to glass transition, J CHEM PHYS, 112(6), 2000, pp. 2933-2944
Citations number
48
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF CHEMICAL PHYSICS
ISSN journal
00219606 → ACNP
Volume
112
Issue
6
Year of publication
2000
Pages
2933 - 2944
Database
ISI
SICI code
0021-9606(20000208)112:6<2933:LBMATA>2.0.ZU;2-O
Abstract
We study the liquid-glass transition of the Lennard-Jones binary mixture in troduced by Kob and Andersen from a thermodynamic point of view. By means o f the replica approach, translating the problem in the study of a molecular liquid, we study the phase transition due to the entropy crisis and we fin d that the Kauzmann's temperature T-K is similar to 0.32. At the end we com pare analytical predictions with numerical results. (C) 2000 American Insti tute of Physics. [S0021-9606(00)50106-8].