منابع مشابه
Aging of Tetrahedral Structure in a Lennard-Jones Glass1
We study the aging of a glassy Lennard-Jones binary mixture with molecular dynamics simulations. We follow the evolution of the packing as a function of the system’s age tw, the time passed since the system is quenched to below its glass transition temperature. We focus on simple properties of all tetrahedra formed by the majority of particles. We find that both the averages and the distributio...
متن کاملMixing effects in glass-forming Lennard-Jones mixtures.
Mixing effects have been investigated from molecular dynamics simulations at constant number of particles, volume, and temperature on the Kob-Andersen glass-forming Lennard-Jones atomic mixture A(x)B(1-x) for 0 < or = x < or = 1 compositions. Upon cooling, crystallization is observed for x < or = 0.5 and x > or = 0.9 compositions. The crystalline states can be described by a quite complex coexi...
متن کاملOff-equilibrium effective temperature in monatomic Lennard-Jones glass.
The off-equilibrium dynamics of a monatomic Lennard-Jones glass is numerically investigated after sudden isothermal density jumps (crunch) from well equilibrated liquid configurations towards the glassy state. The generalized fluctuation-dissipation relation has been studied and the temperature dependence of the violation factor m is found in agreement with the one step replica symmetry breakin...
متن کاملHydrophobicity in Lennard-Jones solutions.
The analogue of the hydrophobic hydration is explored for Lennard-Jones solutions. The free energy of solvation and its temperature derivatives, both in the constant-pressure process and in the constant-volume process, are obtained numerically for a variety of the size and energy parameters for the solute-solvent Lennard-Jones potential. We identify in the parameter space a region in which the ...
متن کاملAnisotropic Lennard-Jones fluids in a nanochannel
During the past few decades molecular dynamics has been a widely applied tool to simulate fluid confined in micro/nano geometries. What makes interfacial fluids fundamentally different from the bulk fluid is the fact that their density varies considerably over microscopic distances. A class of such strongly inhomogeneous fluids are fluids confined in very narrow channels by solid boundaries. In...
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ژورنال
عنوان ژورنال: Physica A: Statistical Mechanics and its Applications
سال: 1999
ISSN: 0378-4371
DOI: 10.1016/s0378-4371(98)00510-x