Browsing Chemical Engineering by Subject "Gases"
Now showing items 1-10 of 10
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A theoretical study of gas adsorption on calcite for CO2 enhanced natural gas recovery
( Elsevier B.V. , 2020 , Article)The adsorption of gas molecules (CO2, CH4, H2O, H2S and N2) on calcite (104) has been studied by means of Density Functional Theory for molecular characterization of Enhanced Gas Recovery (EGR) CO2 injection. Results show ... -
A theoretical study of gas adsorption on calcite for CO2 enhanced natural gas recovery
( European Association of Geoscientists and Engineers, EAGE , 2019 , Conference Paper)The adsorption of gas molecules (CO2, CH4, H2O, H2S and N2) on calcite (104) has been studied by means of Density Functional Theory, in order to investigate the molecular characterization of Enhanced Gas Recovery (EGR) ... -
Ab-Initio Molecular Dynamics investigation of gas adsorption on α-quartz (001) for CO2 enhanced natural gas recovery
( Elsevier B.V. , 2021 , Article)In this work, the interaction of methane and carbon dioxide on α-quartz with surface 001, with a siloxane termination (dense) surface was investigated by means of Ab-Initio Molecular Dynamics. Different temperatures were ... -
CO2 enhanced gas recovery and sequestration in depleted gas reservoirs: A review
( Elsevier B.V. , 2021 , Article Review)Increasing CO2 emissions and global warming side effects have prompted the researchers to look for safe and reliable storage sites that have high capacity. Among the available CO2 capturing sinks, depleted gas reservoirs ... -
Effect of CO2 content on the natural gas production from tight gas sandstone reservoirs
( Society of Petroleum Engineers (SPE) , 2017 , Conference Paper)The simulation of the gas flow in tight sandstone reservoir is a very complicated process. Several mechanisms contributed to the natural gas production in tight sandstone reservoirs. One of the main mechanisms is the gas ... -
Effect of strain on gas adsorption in tight gas carbonates: A DFT study
( Elsevier B.V. , 2021 , Article)The geometrical properties of the reservoir rocks are usually affected by natural thermodynamics or environmental changes. These factors may modify the distribution and the amount of gas in place in the reservoir. To address ... -
Gas Hydrate Prevention and Flow Assurance by Using Mixtures of Ionic Liquids and Synergent Compounds: Combined Kinetics and Thermodynamic Approach
( American Chemical Society , 2016 , Article)The thermodynamic and kinetic hydrates inhibition effects of addition of synergents poly(ethylene oxide) (PEO) and vinyl caprolactum (VCAP) with ionic liquids 1-methyl-1-propylpyrrolidinium chloride [PMPy][Cl] and ... -
Influence of natural gas composition on adsorption in calcite Nanopores: A DFT study
( Elsevier B.V. , 2021 , Article)Density functional theory is used to study the adsorption of natural gas components in calcite (10.4) cylindrical nanopores with 1–4 nm diameters. The change of adsorption energy with the diameter of the nanopores is studied ... -
Interfacial properties of 1-ethyl-3-methylimidazolium glycinate ionic liquid regarding CO2, SO2 and water from molecular dynamics
( Elsevier B.V. , 2016 , Article)The surface properties of 1-ethyl-3-methylimidazolium glycinate ionic liquid, as a model of amino acid-based compounds, in contact with a vacuum, CO2, SO2 and flue gas phases are studied using molecular dynamics simulations. ... -
The effect of vacancy defects on the adsorption of methane on calcite 104 surface
( Elsevier Editora Ltda , 2021 , Article)Density functional theory calculations are used to study the effect of vacancy defects (ionic Ca and charge neutral CO3) on the adsorption properties of CH4 molecule on different calcite surfaces. Both types of vacancy ...