Browsing by Author "Furlan, Alexandre Penteado"
Now showing items 1-4 of 4
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Computational study of the effects of the confinement and the interacting solutes on the properties of the water-like models
(2017) [Thesis]Although the familiarity and simplicity, the water show a set of thermodynamic, dynamics and structural properties which are still subject to intense research. The increase of density as the temperature, of diffusion as ... -
Efeitos de confinamento em “matriz porosa” nas propriedades anômalas de sistemas tipo água
(2013) [Dissertation]Nesta dissertação de mestrado desenvolvemos um estudo acerca do comportamento de sistemas tipo água na presença de uma matriz porosa, esta, definida por partículas fixas. Para isso, foram usadas duas abordagens. Na primeira ... -
Influence of disordered porous media on the anomalous properties of a simple water model
(2015) [Journal article]The thermodynamic, dynamic, and structural behavior of a water-like system confined in a matrix is analyzed for increasing confining geometries. The liquid is modeled by a two-dimensional associating lattice gas model that ... -
Temperature of maximum density and excess properties of short-chain alcohol aqueous solutions : a simplified model simulation study
(2017) [Journal article]We perform an extensive computational study of binary mixtures of water and short-chain alcohols resorting to two-scale potential models to account for the singularities of hydrogen bonded liquids. Water molecules are ...
