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

被引:32
作者
da Silva, Jonathas Nunes [1 ]
Salcedo, Evy [2 ]
de Oliveira, Alan Barros [3 ]
Barbosa, Marcia C. [1 ]
机构
[1] Univ Fed Rio Grande do Sul, Inst Fis, BR-91501970 Porto Alegre, RS, Brazil
[2] Univ Fed Santa Catarina, Dept Fis, BR-88010970 Florianopolis, SC, Brazil
[3] Univ Fed Ouro Preto, Dept Fis, BR-35400000 Ouro Preto, MG, Brazil
关键词
LIQUID PHASE-TRANSITION; WATER; DIFFUSION; BEHAVIOR; SYSTEM; QUANTIFICATION; MECHANISM; FLUIDS; ORDER;
D O I
10.1063/1.3511704
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
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. (C) 2010 American Institute of Physics. [doi:10.1063/1.3511704]
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页数:9
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