Listar por tema "Gibbs free energy"
Mostrando ítems 1-2 de 2
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Molecular simulations of fluoxetine in hydrated lipid bilayers, as well as in aqueous solutions containing β-cyclodextrin
(2022)Fluoxetine, which is a well-known antidepressant drug, is studied in hydrated cholesterol-free and cholesterol-containing lipid bilayers through unbiased and biased atomistic molecular dynamics simulations. The latter are ... -
Thermodynamic investigation of the RbBr-TbBr3 system
(2010)The thermodynamic properties and phase diagram of the RbBr-TbBr3 system were analyzed by means of the CALPHAD method in this work. Thermodynamic models were defined in order to describe the Gibbs energies of the individual ...