Fragility and glassy dynamics of 2Ca(NO(3))(2)center dot 3KNO(3) under pressure: Molecular dynamics simulations


Autoria(s): RIBEIRO, Mauro C. C.; SCOPIGNO, Tullio; RUOCCO, Giancarlo
Contribuinte(s)

UNIVERSIDADE DE SÃO PAULO

Data(s)

19/04/2012

19/04/2012

2008

Resumo

Molecular dynamics simulations of the glass-forming liquid 2Ca(NO(3))(2)center dot 3KNO(3) (CKN) were performed from high temperature liquid states down to low temperature glassy states at six different pressures from 10(-4) to 5.0 GPa. The temperature dependence of the structural relaxation time indicates that the fragility of liquid CKN changes with pressure. In line with recent proposal [Scopigno , Science 302, 849 (2003)], the change on liquid fragility is followed by a proportional change of the nonergodicity factor of the corresponding glass at low temperature. (c) 2008 American Institute of Physics.

Identificador

JOURNAL OF CHEMICAL PHYSICS, v.128, n.19, 2008

0021-9606

http://producao.usp.br/handle/BDPI/16809

10.1063/1.2931525

http://dx.doi.org/10.1063/1.2931525

Idioma(s)

eng

Publicador

AMER INST PHYSICS

Relação

Journal of Chemical Physics

Direitos

openAccess

Copyright AMER INST PHYSICS

Palavras-Chave #FORMING LIQUIDS #NITRATE MELTS #TRANSITION #RELAXATION #CA0.4K0.6(NO3)(1.4) #TEMPERATURE #DEPENDENCE #TRANSPORT #Physics, Atomic, Molecular & Chemical
Tipo

article

original article

publishedVersion