Search Results - "Tavares, Frederico Wanderley"
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Current status of Lattice Boltzmann Methods applied to aerodynamic, aeroacoustic, and thermal flows
Published in Progress in aerospace sciences (01-05-2020)“…We present a review of the evolutionary advancement of the lattice Boltzmann methods (LBM) and current status of their applications in dealing with diverse…”
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Evaluation of Microwave and Conventional Heating for Electrostatic Treatment of a Water-in-Oil Model Emulsion in a Pilot Plant
Published in Energy & fuels (15-06-2017)“…The efficiency of electrostatic coalescence coupled with microwave heating in separation of water-in-oil (W/O) model emulsions was evaluated. A series of…”
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Pollution caused by nanoplastics: adverse effects and mechanisms of interaction via molecular simulation
Published in PeerJ (San Francisco, CA) (25-07-2022)“…The continuous increase in the production of synthetic plastics for decades and the inadequate disposal of plastic waste have resulted in a considerable…”
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Thermophysical Properties of Amorphous‐Paracrystalline Celluloses by Molecular Dynamics
Published in Macromolecular theory and simulations (01-07-2020)“…For the engineering and process design of chemical and pharmaceutical plants, the knowledge of thermophysical properties is essential. Here, glass transition…”
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Investigation of adsorption-enhanced reaction process of mercury removal from simulated natural gas by mathematical modeling
Published in Fuel (Guildford) (01-08-2014)“…[Display omitted] •The proposed model for Hg fixation involves adsorption, diffusion and chemical reaction.•Experimental data are obtained for low…”
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Electro-rheological investigation on W/O emulsions morphology under electric fields
Published in Journal of dispersion science and technology (03-08-2020)“…Five w/o model emulsions were produced using mineral oil, deionized water and Span 80. The samples of higher stability and smaller mean droplet size were…”
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Tween-80 on Water/Oil Interface: Structure and Interfacial Tension by Molecular Dynamics Simulations
Published in Langmuir (07-03-2023)“…Surfactants are used in many fields of the chemical industry in a wide range of applications. Generally, surfactants on water/oil interfaces reduce interfacial…”
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Lattice Boltzmann Methods for Industrial Applications
Published in Industrial & engineering chemistry research (11-09-2019)“…We present an overview of recent advancements and potentialities for industrial applications of lattice Boltzmann methods (LBMs). Various processes and…”
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New Cascaded Thermal Lattice Boltzmann Method for simulations of advection-diffusion and convective heat transfer
Published in International journal of thermal sciences (01-08-2017)“…A Cascaded Thermal Lattice Boltzmann Method (CTLBM) is presented for efficient simulations of fluid flow and heat transfer problems. Contrary to the…”
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A Nonequilibrium Chemical Affinity-Based Hydrate Growth Model: Applied to the CH 4 Hydrate
Published in Journal of chemical and engineering data (08-02-2024)Get full text
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Natural convection heat transfer modeling by the cascaded thermal lattice Boltzmann method
Published in International journal of thermal sciences (01-12-2018)“…In this article, we present application of the Cascaded Thermal Lattice Boltzmann Method (CTLBM) in simulations of natural convection in differentially heated…”
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Sixty Years of the van der Waals and Platteeuw Model for Clathrate HydratesA Critical Review from Its Statistical Thermodynamic Basis to Its Extensions and Applications
Published in Chemical reviews (23-12-2020)“…In light of the 60-year anniversary of the publishing of “Clathrate Solutions” by van der Waals and Platteeuw in 2019, we present a critical review of the…”
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Physical–Chemical Properties of Compressible Clathrates: A Natural Pressure Shift by Extending the van der Waals and Platteeuw Model
Published in Journal of physical chemistry. C (10-02-2022)“…We have developed a new model for compressible clathrates that extends the well-known van der Waals and Platteeuw model. The new model is derived by dispensing…”
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A Nonequilibrium Chemical Affinity-Based Hydrate Growth Model: Applied to the CH4 Hydrate
Published in Journal of chemical and engineering data (08-02-2024)“…While hydrate formation conditions are commonly present in natural gas offshore production, where hydrates can cause undesirable blockages, the natural…”
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Molecular dynamics of dissolution of a 36-chain cellulose Iβ microfibril at different temperatures above the critical pressure of water
Published in Journal of molecular liquids (15-08-2021)“…[Display omitted] •First study of heating dynamics of 36-chain cellulose Iβ with water up to supercritical water regime.•Validation of CHARMM36 force field to…”
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Amorphous paracrystalline structures from native crystalline cellulose: A molecular dynamics protocol
Published in Fluid phase equilibria (01-07-2019)“…Cellulose amorphization is a suitable process that allows greater accessibility of cellulolytic enzymes to glycosidic bonds of cellulose, thus improving the…”
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Classical density functional theory of confined fluids: From getting started to modern applications
Published in Fluid phase equilibria (01-11-2024)“…The application of classical density functional theory (cDFT) to model confined fluids is an outstanding example of directly using fundamental scientific…”
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Molecular Dynamics Study of Thermophysical and Mechanical Properties in Hydrated Lignin with Compositions Close to Softwood
Published in ACS sustainable chemistry & engineering (09-01-2023)“…The hydrogen bonding network analysis of softwood lignin is relevant to designing novel technologies to overcome the recalcitrance of plant biomass in the…”
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The binding interaction of protein on a charged surface using Poisson–Boltzmann equation: lysozyme adsorption onto SBA-15
Published in Adsorption : journal of the International Adsorption Society (01-10-2021)“…A modified Poisson–Boltzmann model (PBEm) can be successfully used to determine the binding strength parameter, i.e., (Henry constant, K ), for the protein…”
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