325 results on '"Tavares, Frederico W."'
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52. Photochemical reactor for selective hydrogenation of asphaltene molecules at room temperature in absence of a catalyst
53. A New Formulation for the Concerted Alchemical Calculation of van der Waals and Coulomb Components of Solvation Free Energies
54. A unified interaction model for multiphase flows with the lattice Boltzmann method
55. Liquid–liquid equilibria of ternary mixtures of methanol + MEG + n‐C5, ethanol + MEG + n‐C5, and n‐butanol + MEG + n‐C5.
56. Real Electrolyte Solutions in the Functionalized Mean Spherical Approximation: A Density Functional Theory for Simple Electrolyte Solutions
57. Synthesis of polyglobalide by enzymatic ring opening polymerization using pressurized fluids
58. A First Approach towards Adsorption-Oriented Physics-Informed Neural Networks: Monoclonal Antibody Adsorption Performance on an Ion-Exchange Column as a Case Study
59. Propagation of Uncertainties in Frontal Analysis Method: A Bayesian and Frequentist Evaluation of Adsorption Isotherms for Praziquantel Enantiomers
60. Influence of Temperature on Selectivity and Retention of Praziquantel Enantiomers: A Bayesian Analysis of the Enthalpy and Entropy of Adsorption
61. Critical behavior of pure confined fluids from an extension of the van der Waals equation of state
62. High-pressure phase diagram of the drug mitotane in compressed and/or supercritical CO 2
63. Thermodynamic modeling of confined fluids using an extension of the generalized van der Waals theory
64. Descrição do Comportamento Volumétrico de Sistemas Água + Eletrólitos Utilizando o Software OLI Studio
65. A unified interaction model for multiphase flows with the lattice Boltzmann method.
66. Parameter estimation of kinetic cure using DSC non-isothermal data
67. Cure kinetic parameter estimation of thermosetting resins with isothermal data by using particle swarm optimization
68. Ion-specific potential of mean force between two aqueous proteins
69. A self-consistent perturbative density functional theory for hard-core fluids: phase diagrams, structural and interfacial properties
70. Helmholtz Scaling: An Alternative Approach to Calculate Viscosity with the PCP-SAFT Equation of State
71. Analytic calculation of phase diagrams for solutions containing colloids or globular proteins
72. Modifying the Poisson–Boltzmann Approach to Model Specific Ion Effects
73. Modified clustering algorithm for molecular simulation
74. Fick Diffusion Coefficients via Molecular Dynamics: An Alternative Approach in the Fourier Domain
75. Phase behavior of systems with high CO2 content: Experiments and thermodynamic modeling
76. Inferring kinetic dissolution of NaCl in aqueous glycol solution using a low‐cost apparatus and population balance model
77. Self- and mutual diffusion coefficient equation for pure fluids, liquid mixtures and polymeric solutions
78. Centrifugation equilibrium of natural gas
79. Thermodynamic equilibrium in systems with multiple adsorbed and bulk phases
80. Influence of particle shape on the packing and on the segregation of spherocylinders via Monte Carlo simulations
81. Equilíbrio Líquido-Líquido, Solubilidade do monoetileno glicol MEG em n-pentano na presença de metanol etanol ou 1-butanol
82. Determination of Fick Diffusion coefficients for mixtures of hydrocarbons and CO2 in reservoir conditions using Molecular Dynamics
83. Renormalization Group Theory Applied To Cubic Equations of State: Phase Equilibria, Derivative Properties and Fluctuation Analysis
84. Model for Diffusivity and Viscosity in Simple Organic Liquids based on Lattice-Hole Framework and Molecular Descriptors
85. Renormalization group theory applied to the CPA equation of state: Impacts on phase equilibrium and derivative properties
86. Concentration and Solvent Effects on Structural, Dynamical, and Rheological Properties of Asphaltene Suspensions
87. Phase Equilibria Data and Thermodynamic Analysis for Liquid–Hydrate–Vapor (LHV) with High Ethanol Concentrations
88. Adsorption of Gases on Zeolitic Imidazolate Frameworks: Modeling with Equations of State for Confined Fluids and Pore Size Distribution Estimation
89. Self-Diffusion Coefficients of Methane/n-Hexane Mixtures at High Pressures: An Evaluation of the Finite-Size Effect and a Comparison of Force Fields
90. Pore size distributions from extended Peng-Robinson equations of state for fluids confined in cylindrical and slit pores
91. Wax appearance and prevention in two-phase flow using the multi-solid and drift-flux model
92. Renormalization Group Theory Applied to the CPA Equation of State: Impacts on Phase Equilibrium and Derivative Properties
93. Determination of self-diffusion coefficients for CO2 and n-alkanes mixtures under high pressures using Molecular Dynamics: a comparison between methodologies and force fields
94. Wettability of rock, oil and brine system based on density functional theory
95. A Molecular Dynamics Study of the Solvation of Carbon Dioxide and Other Compounds in the Ionic Liquids [emim][B(CN)4] and [emim][NTf2]
96. Molecular dynamics simulation and experimental validation by X-ray data of hydroxyapatite crystalline structures
97. CHEMICAL POTENTIALS OF HARD-CORE MOLECULES BY A STEPWISE INSERTION METHOD
98. A new simple and efficient flash algorithm for T-v specifications
99. Liquid film flow and area generation in structured packed columns
100. A phase stability analysis of the combinatorial term of the UNIQUAC model
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