Fluid and solid phases of the Gaussian core model

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0 Fluid and solid phases of the Gaussian core model

We study the structural and thermodynamic properties of a model of point particles interacting by means of a Gaussian pair potential first introduced by Stillinger [Stillinger F H 1976 J. Chem. Phys. 65 3968]. By employing integral equation theories for the fluid state and comparing with Monte Carlo simulation results, we establish the limits of applicability of various common closures and exam...

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Fluid and solid phases of the Gaussian core model

We study the structural and thermodynamic properties of a model of point particles interacting by means of a Gaussian pair potential first introduced by Stillinger (Stillinger F H 1976 J. Chem. Phys. 65 3968). By employing integral equation theories for the fluid state and comparing with Monte Carlo simulation results, we establish the limits of applicability of various common closures and exam...

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We show that the Gaussian core model of particles interacting via a penetrable repulsive Gaussian potential, first considered by Stillinger [J. Chem. Phys. 65, 3968 (1976)], behaves as a weakly correlated "mean-field fluid" over a surprisingly wide density and temperature range. In the bulk, the structure of the fluid phase is accurately described by the random phase approximation for the direc...

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ژورنال

عنوان ژورنال: Journal of Physics: Condensed Matter

سال: 2000

ISSN: 0953-8984,1361-648X

DOI: 10.1088/0953-8984/12/24/302