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Ion transfer across liquid|liquid interface under forced hydrodynamic conditions. I: Digital simulations
(Elsevier Science Sa, 2012-02)
In this paper, we present the general equations for a model that describes ion transfer reactions across the oil|water interface assisted by a ligand, under forced hydrodynamic conditions. Our analysis is mainly focused ...
Solvation response of polar liquid mixtures: Water-dimethylsulfoxide
(Amer Inst PhysicsMelvilleEUA, 1999)
Structure of acetone and dimethyl sulfoxide from Monte Carlo simulations and MM2 calculations
(Taylor & Francis Ltd, 2007-02-01)
The structure of acetone and dimethyl sulfoxide in the liquid phase is investigated using Monte Carlo simulations and MM2 calculations. The principal site - site correlations and degree of structure in both liquids have ...
Structure of acetone and dimethyl sulfoxide from Monte Carlo simulations and MM2 calculations
(Taylor & Francis Ltd, 2007-02-01)
The structure of acetone and dimethyl sulfoxide in the liquid phase is investigated using Monte Carlo simulations and MM2 calculations. The principal site - site correlations and degree of structure in both liquids have ...
Structure and weak hydrogen bonds in liquid acetaldehyde
(2004-08-30)
Monte Carlo simulations have been performed to investigate the structure and hydrogen bonds formation in liquid acetaldehyde. An all atom model for the acetaldehyde have been optimized in the present work. Theoretical ...
Statistical thermodynamics of liquids using the Monte Carlo method. II. Liquid chloroform.
(Soc Brasileira QuimicaSao PauloBrasil, 1999)
Designing and understanding permanent microporosity in liquids
(Royal Society of Chemistry, 2014-03)
Standard microporous materials are typically crystalline solids that exhibit a regular array of cavities of uniform size and shape. Packing and directional bonding between molecular building blocks give rise to interstitial ...
Liquid-liquid equilibria for systems composed of rice bran oil and alcohol-rich solvents: Application to extraction and deacidification of oil
(ELSEVIER SCI LTDOXFORD, 2012)
The liquid-liquid equilibria of systems composed of rice bran oil, free fatty acids, ethanol and water were investigated at temperatures ranging from 10 to 60 degrees C. The results of the present study indicated that the ...
Numerical simulation of mass transfer in circulating drops
(Elsevier, 2010-05)
Numerical simulations of mass transfer are performed for a circulating liquid drop with applications in liquid–liquid extraction. Simulation parameters are chosen for a multi-component ternary system acetone–methanol–benzene. ...