Mert Atilhan

Western Michigan University

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Santiago Aparício

Universidad de Burgos

182

Alberto Gutiérrez

Universidad de Burgos

Rafael Alcalde

Universidad de Burgos

Cafer T. Yavuz

King Abdullah University of Science and Technology

Gregorio García

Universidad de Valladolid

Ruh Ullah

National Institute for Materials Science

Ferdi Karadaş

Bilkent University

Kenneth R. Hall

Texas A&M University

Majeda Khraisheh

Qatar University

Tausif Altamash

Hamad bin Khalifa University

Cooperative Institutions

Qatar University

Universidad de Burgos

Korea Advanced Institute of Science and Technology

Texas A&M University

University College London

Western Michigan University

Texas A&M University at Qatar

University of Sheffield

Mitchell Institute

Queen's University Belfast

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Insights on the mixtures of imidazolium based ionic liquids with molecular solvents

Journal of Molecular Liquids (2018)

Alberto Gutiérrez Mert Atilhan Rafael Alcalde José L. Trenzado Santiago Aparício

Dimethyl formamide

10.1016/j.molliq.2018.01.167

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Citations (35)

P-ρ-T Data for Carbon Dioxide from (310 to 450) K up to 160 MPa

Journal of Chemical & Engineering Data (2010)

I. Mantilla Diego E. Cristancho Saquib Ejaz Kenneth R. Hall Mert Atilhan

This paper presents P-ρ-T data for pure carbon dioxide measured with a high-pressure single-sinker magnetic suspension densimeter (MSD). The data cover four isotherms (310, 350, 400, 450) K. The MSD technique yields data with less than 0.03 % relative uncertainty over the pressure range of (10 to 200) MPa. A comparison of the experimental data to the equation of state developed by Span and Wagner indicates that the equation and the data are consistent within the low range of pressure. The reference equation has a relative uncertainty of ± 0.03 % to ± 0.05 % below 30 MPa. At higher pressures, the density predictions of this model agree with the experimental data with a maximum relative deviation of 0.1 %.

Relative standard deviation

Absolute deviation

Experimental data

10.1021/je1001158

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Citations (32)

Accurate PρT Data for Ethane from (298 to 450) K up to 200 MPa

Journal of Chemical & Engineering Data (2010)

Diego E. Cristancho I. Mantilla Saquib Ejaz Kenneth R. Hall Mert Atilhan

This paper reports PρT data measured with a high-pressure, single-sinker, magnetic-suspension densimeter (MSD) from (298 to 450) K up to 200 MPa. The MSD technique yields accurate data, with less than 0.05 % relative uncertainty, over the pressure range of (10 to 200) MPa. The Bücker and Wagner equation of state as implemented in RefProp 8.0 compares well to the experimental data. RefProp 8.0 has a relative uncertainty of (0.02 to 0.03) % up to 30 MPa. The equation predicts data with almost the same uncertainty as the experimental data up to 200 MPa. These PρT data also allow reliable determination of both second and third virial coefficients.

Experimental data

10.1021/je900978x

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Citations (13)

Enhanced water purification with hydrophobic natural deep eutectic solvents focused on phenolic compounds removal

Journal of Water Process Engineering (2024)

Neha Sawant Noor Alomari Juan Aguilar M. Vélez Mario Lizardo

Hydrophobic effect

10.1016/j.jwpe.2024.106106

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A comprehensive study on carbon capture potential of lactic acid based deep eutectic solvents at wide process conditions

Journal of Molecular Liquids (2023)

Ahmad Al-Bodour Noor Alomari Santiago Aparício Mert Atilhan

10.1016/j.molliq.2023.123114

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Citations (2)

High-Pressure Carbon Dioxide Solubility in Terpene Based Deep Eutectic Solvents

SSRN Electronic Journal (2022)

Ahmad Al-Bodour Noor Alomari Alberto Gutiérrez Santiago Aparício Mert Atilhan

This work investigates carbon dioxide solubility performances for four type V natural deep eutectic solvents (NADES). The studied solvents have hydrophobic nature, and they were prepared by using carvone (CAR), cineole (CIN), thymol (THY), and menthol (MEN). Solubilities of carbon dioxide (CO2) have been determined via new apparatus that uses the isochoric saturation method. The apparatus has been validated against a widely studied calibration fluid, which was selected as choline chloride (ChCl) and urea system, a.k.a. reline. The studied solvent NADES have been tested at 25°C and 35°C isotherms and pressures up to 40 bar. Material characterization, including Fourier transfer infrared (FTIR) and thermal gravimetric analysis (TGA), have been obtained and presented. The experimental heat of absorption of CO2 presented as a function pressure, and the CO2 sorption kinetics presented based on the fractional amount of absorbed CO2 versus time. The results demonstrated that the solubility of CO2 in monoterpenoid-based hydrophobic NADES increased with increasing pressure and decreasing temperature. In addition to their hydrophobic nature, high CO2 sorption performance with rapid CO2 solubility rate make NADES good candidates for future carbon management applications.

Terpene

Supercritical Carbon Dioxide

10.2139/ssrn.4069725

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Folding of Graphene Nanostructures Driven by Ionic Liquids Nanodroplets

The Journal of Physical Chemistry C (2014)

Mert Atilhan Santiago Aparício

The folding of graphene nanostructures driven by ionic liquid nanodroplets is studied by molecular dynamics simulations. Nanodroplets formed by nine different ionic liquids comprising alkylimidazolium, cholinium, and N-methylpiperazinium cations, paired with BF4, Tf2N, lactate, salicylate, and benzoate anions were studied. The interaction between these fluids and graphene nanoribbons was considered by the analysis of the effect of nanoribbons width and also complex geometries such as flower-like and planar graphene flakes. Likewise, the possibility of folding of graphene nanostructures supported on SiO2 was also analyzed. The folding mechanism driven by nine ionic liquids is analyzed showing the evolution of the different interaction energies. The reported results show suitable application of ionic liquid nanodroplets for controlling the folding of graphene nanoribbons, although those supported on SiO2 surfaces could not be folded by the studied systems.

Folding (DSP implementation)

10.1021/jp502303q

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Citations (14)

Membranes for CO ₂ Separation

Abedalkader Alkhouzaam Majeda Khraisheh Mert Atilhan Shaheen A. Al‐Muhtaseb Syed Javaid Zaidi

This chapter contains sections titled: Introduction Fundamentals of Membrane Gas Separation Polymeric Membranes for CO2 Separation Mixed Matrix Membranes Supported Ionic Liquid Membranes (SILMs) for CO2 Separation Conclusion Overall Comparison and Future Outlook Abbreviations

Separation (statistics)

Membrane Technology

10.1002/9781118831779.ch7

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Citations (1)

A density functional theory insight towards the rational design of ionic liquids for SO₂capture

Physical Chemistry Chemical Physics (2015)

Gregorio García Mert Atilhan Santiago Aparício

A systematic density functional theory (DFT) analysis has been carried out to obtain information at the molecular level on those factors related to efficient SO₂capture by ionic liquids. A set of 55 ionic liquids, for which high gas solubility is expected, has been selected.

Rational design

10.1039/c5cp00076a

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Citations (39)

Insights from quantum chemistry into piperazine-based ionic liquids and their behavior with regard to CO2

Journal of Molecular Modeling (2014)

Virginia Sanz Rafael Alcalde Mert Atilhan Santiago Aparício

Antibonding molecular orbital

Natural bond orbital

Lone pair

Atoms in molecules

Carboxylate

10.1007/s00894-014-2107-x

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Citations (17)