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Bad Gastein, January 2005
Gels and Strong Liquids
In collaboration with S. Bulderyev,C. De Michele, E. La Nave, A. Moreno, I. Saika-Voivod, P. Tartaglia, E. Zaccarelli
Geometric Constraint: Maximum Valency
SW if # of bonded particles <= Nmax
HS if # of bonded particles > Nmax
V(r)
r
Viscosity and Diffusivity: Arrhenius
• =1
• Cv small
• Stokes-Einstein Relation
Other strong properties:
percolating
Ground State Energy Known !
•It is possible to equilibrate at low T !
•E(T) is known and hence free energy can be calculated exactly down to T=0
It is possible to calculate exactly the vibrational entropy of one single bonding pattern
(basin free energy)
(Ladd andFrenkel)
Thermodynamics in the Stillinger-Weber formalism
F(T)=-T Sconf(E(T))+fbasin(E,T)
with
Fbasin (E)
and
Sconf(E)=kBln[(E)]
Sampled Space with E bonds
Number of configurations with E bonds
sconf
•Comment:In models for fragile liquids, the number of configurations with energy E has been found to be gaussian distributed
Non zero ground state entropy
Landscape of strong and fragile liquids
Realistic ModelNetwork
Primitive Model for Network
Fragile Liquid
Points for discussions….
• Sticky points colloids: •Candidates for Gel formations by suppression of the spinodal decomposition• Candidates for strong liquid behavior.
• Landscape differences between strong and fragile liquids.•Is the configurational entropy of strong liquids at low T (in the classical limit) non zero
• Proteins: • Sticky areas. Gel if favored. Role of the space correlation between the points. No crystals for special sticky points configurations ?