Fragility and glassy dynamics of 2Ca(NO(3))(2)center dot 3KNO(3) under pressure: Molecular dynamics simulations
Contribuinte(s) |
UNIVERSIDADE DE SÃO PAULO |
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Data(s) |
19/04/2012
19/04/2012
2008
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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 |
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 |