Core-softened fluids, water-like anomalies, and the liquid-liquid critical points

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Core-softened fluids, water-like anomalies, and the liquid-liquid critical points.

Molecular dynamics simulations are used to examine the relationship between water-like anomalies and the liquid-liquid critical point in a family of model fluids with multi-Gaussian, core-softened pair interactions. The core-softened pair interactions have two length scales, such that the longer length scale associated with a shallow, attractive well is kept constant while the shorter length sc...

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Liquid-State Anomalies and the Stell-Hemmer Core-Softened Potential

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Metastable liquid-liquid coexistence and density anomalies in a core-softened fluid.

Linearly sloped or "ramp" potentials belong to a class of core-softened models which possess a liquid-liquid critical point (LLCP) in addition to the usual liquid-gas critical point. Furthermore, they exhibit thermodynamic anomalies in their density and compressibility, the nature of which may be akin to those occurring in water. Previous simulation studies of ramp potentials have focused on ju...

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Phase behaviour and thermodynamic anomalies of core-softened fluids

We report extensive simulation studies of phase behaviour in single component systems of particles interacting via a core-softened interparticle potential. Two recently proposed examples of such potentials are considered; one in which the hard core exhibits a shoulder, (Sadr-Lahijany et al, Phys. Rev. Lett. 81, 4895 (1998)) and the other in which the softening takes the form of a linear ramp (J...

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Phase behavior and thermodynamic anomalies of core-softened fluids.

We report extensive simulation studies of phase behavior in single component systems of particles interacting via a core-softened interparticle potential. Two recently proposed examples of such potentials are considered; one in which the hard core exhibits a shoulder [Sadr-Lahijany et al., Phys. Rev. Lett. 81, 4895 (1998)], and the other in which the softening takes the form of a linear ramp [J...

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ژورنال

عنوان ژورنال: The Journal of Chemical Physics

سال: 2011

ISSN: 0021-9606,1089-7690

DOI: 10.1063/1.3613669