Preprint Article Version 1 Preserved in Portico This version is not peer-reviewed

London Dispersive and Lewis Acid-Base Surface Energy of 2D Single-Crystalline and Polycrystalline Covalent Organic Frameworks

Version 1 : Received: 18 January 2024 / Approved: 19 January 2024 / Online: 22 January 2024 (09:30:50 CET)

A peer-reviewed article of this Preprint also exists.

Hamieh, T. London Dispersive and Lewis Acid-Base Surface Energy of 2D Single-Crystalline and Polycrystalline Covalent Organic Frameworks. Crystals 2024, 14, 148. Hamieh, T. London Dispersive and Lewis Acid-Base Surface Energy of 2D Single-Crystalline and Polycrystalline Covalent Organic Frameworks. Crystals 2024, 14, 148.

Abstract

This paper is devoted to an accurate determination of the London dispersive and polar free energy of adsorption, the two Lewis acid γs+ and base γs- components of polar surface energy γsAB of 2D single-crystalline and polycrystalline covalent organic frameworks such as TAPPy-TPA-COFs. Inverse gas chromatography (IGC) at infinite dilution was used to quantify the different surface parameters of the different materials. From IGC measurements, one determined the net retention time of the adsorption of n-alkanes and several polar solvents on single-crystalline and polycrystalline covalent organic frameworks. The free surface Gibbs energy of adsorption was obtained for the various organic molecules at different temperatures from their net retention volume values. The separation between the London dispersive energy and the polar energy of adsorbed molecules was carried out by using a new thermodynamic parameter PSX chosen as new indicator variable and taken into account the deformation polarizability and the harmonic mean of the ionization energies of solvents and solid materials, derived from London dispersion equation. The obtained results are very promising for the accurate determination of the surface thermodynamic parameters of adsorption of organic solvents on solid surfaces.

Keywords

deformation polarizability; ionization energy; London dispersive free energy; polar energy of adsorption; Lewis’s acid-base components of surface energy; molecular separation distance

Subject

Chemistry and Materials Science, Chemical Engineering

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