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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. ...
A molecular dynamics study on aminoacid-based ionic liquids
(
Elsevier
, 2016 , Article)
The properties of aminoacid based ionic liquids are studied using classic molecular dynamic simulations. Ionic liquids comprising glycine, serine, alanine and phenyl alanine anions combined with 1-ethyl-3-methylimidazolium, ...
Alternatives to amine-based capture & new technologies
(
Hamad bin Khalifa University Press (HBKU Press)
, 2012 , Report)
Large improvements in separations technology will require novel materials with enhanced properties and performance. The fundamental interlinks for success in merging synthesis and process incorporation are the structure, ...
Investigation of the performance of biocompatible gas hydrate inhibitors via combined experimental and DFT methods
(
Academic Press
, 2017 , Article)
In this work, three ionic liquids (ILs) from the bio-compatible family of choline cations attached to anions of varying hydrophobicity namely: choline acetate (ChOAc), choline bistriflamide (ChNtf2), and choline chloride ...
Ionic liquids as dual functional inhibitors for natural gas hydrates (NGH)
(
AIChE
, 2017 , Conference Paper)
The thermodynamic inhibition (TI) and kinetic inhibition (KI) effect of pyrrolidinium based Ionic liquids (ILs) 1-Methyl-1-Propyl-pyrrolidinium Chloride [PM-Py][Cl] and 1-Methyl-1-Propyl-pyrrolidinium Triflate [PM-Py][Triflate] ...
Intercalation of ionic liquids into bentonite: Swelling and rheological behaviors
(
Elsevier B.V.
, 2016 , Article)
In this study, direct intercalation of three different green ionic liquids (ILs) having different salt and cation sizes into bentonite interlayer is investigated. The ILs covered in this study are: 1-hexyl-3-methylimidazolium ...
A comprehensive review on the rheological behavior of imidazolium based ionic liquids and natural deep eutectic solvents
(
Elsevier B.V.
, 2019 , Article Review)
The rheological behavior of a fluid is an important property that has a distinct impact on its flow conduct, which influence viscosity dependent phenomena and applications such as pumping, mass transfer rates, and ...
A systematic visual methodology to design ionic liquids and ionic liquid mixtures: Green solvent alternative for carbon capture
(
Elsevier Ltd
, 2016 , Article)
Ionic liquids (ILs) have gained great interest recently to substitute volatile organic compounds (VOCs), since their properties can be tuned to match certain targets and applications. Further to this, another possibility ...
High pressure CO2 absorption studies on imidazolium-based ionic liquids: Experimental and simulation approaches
(2013 , Article)
A combined experimental-computational study on the CO2 absorption on 1-butyl-3-methylimidazolium hexafluophosphate, 1-ethyl-3-methylimidazolium bis[trifluoromethylsulfonyl]imide, and 1-butyl-3-methylimidazolium ...
Ionic liquid design for enhanced carbon dioxide capture by computer-aided molecular design approach
(
Springer Verlag
, 2015 , Article)
Carbon capture and storage is an emerging technology to mitigate carbon dioxide (CO2) emissions from industrial sources such as power plants. Post-combustion capture based on aqueous amine scrubbing is one of the most ...