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Effects of the attractive interactions in the thermodynamic, dynamic, and structural anomalies of a two length scale potential.

Authors :
da Silva JN
Salcedo E
de Oliveira AB
Barbosa MC
Source :
The Journal of chemical physics [J Chem Phys] 2010 Dec 28; Vol. 133 (24), pp. 244506.
Publication Year :
2010

Abstract

Using molecular dynamic simulations, we study a system of particles interacting through a continuous core-softened potentials consisting of a hard core, a shoulder at closest distances, and an attractive well at further distance. We obtain the pressure-temperature phase diagram of this system for various depths of the tunable attractive well. Since this is a two length scale potential, density, diffusion, and structural anomalies are expected. We show that the effect of increasing the attractive interaction between the molecules is to shrink the region in pressure in which the density and the diffusion anomalies are present. If the attractive forces are too strong, particle will be predominantly in one of the two length scales and no density of diffusion anomaly is observed. The structural anomalous region is present for all the cases.

Details

Language :
English
ISSN :
1089-7690
Volume :
133
Issue :
24
Database :
MEDLINE
Journal :
The Journal of chemical physics
Publication Type :
Academic Journal
Accession number :
21198001
Full Text :
https://doi.org/10.1063/1.3511704