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A Straightforward Method to Prepare MOF-Based Membranes via Direct Seeding of MOF-Polymer Hybrid Nanoparticles.

ABSTRACT: Metal Organic Frameworks (MOFs) present high surface areas, various pore topology as well as good stabilities. The functionalities and porosity can be tuned by using different linkers with various functional groups and a wide range of linker lengths. These properties make them good candidates in membrane separation applications. In this work, we propose a simple UiO-66 MOF-based membrane fabrication method following two steps. First, the α-alumina tubular membrane support was dip-coated with MOF-polymer hybrid nanoparticles (NPs). These NPs were prepared via one-pot synthesis by adding poly (methacrylic acid)-b-poly (methyl methacrylate) (PMAA-b-PMMA) NPs to the classical acetic acid-modulated UiO-66 or UiO-66-NH₂ synthesis formulation. Second, secondary membrane growth was applied to give rise to a continuous and homogeneous crystalline MOF membrane layer. The gas permeances (He, N₂, CO₂ and SF₆) tests confirmed high membrane permeability with no macro-defects. The as-prepared membranes that were used for dye separation (Rhodamine B) showed relatively good separation capacity.

SUBMITTER: Fang M

PROVIDER: S-EPMC9864354 | biostudies-literature | 2023 Jan

REPOSITORIES: biostudies-literature

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A Straightforward Method to Prepare MOF-Based Membranes via Direct Seeding of MOF-Polymer Hybrid Nanoparticles.

Fang Mingyuan M Drobek Martin M Cot Didier D Montoro Carmen C Semsarilar Mona M

Membranes 20230104 1

Metal Organic Frameworks (MOFs) present high surface areas, various pore topology as well as good stabilities. The functionalities and porosity can be tuned by using different linkers with various functional groups and a wide range of linker lengths. These properties make them good candidates in membrane separation applications. In this work, we propose a simple UiO-66 MOF-based membrane fabrication method following two steps. First, the α-alumina tubular membrane support was dip-coated with MOF ...[more]

PMID: 36676872

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Project description:Several thousands of metal organic frameworks (MOFs) have been reported to date, but the information on H2/N2 separation performances of MOF membranes is currently very limited in the literature. We report the first large-scale computational screening study that combines state-of-the-art molecular simulations, grand canonical Monte Carlo (GCMC) and molecular dynamics (MD), to predict H2 permeability and H2/N2 selectivity of 3765 different types of MOF membranes. Results showed that MOF membranes offer very high H2 permeabilities, 2.5 × 103 to 1.7 × 106 Barrer, and moderate H2/N2 membrane selectivities up to 7. The top 20 MOF membranes that exceed the polymeric membranes' upper bound for H2/N2 separation were identified based on the results of initial screening performed at infinite dilution condition. Molecular simulations were then carried out considering binary H2/N2 and quaternary H2/N2/CO2/CO mixtures to evaluate the separation performance of MOF membranes under industrial operating conditions. Lower H2 permeabilities and higher N2 permeabilities were obtained at binary mixture conditions compared to the ones obtained at infinite dilution due to the absence of multicomponent mixture effects in the latter. Structure-performance relations of MOFs were also explored to provide molecular-level insights into the development of new MOF membranes that can offer both high H2 permeability and high H2/N2 selectivity. Results showed that the most promising MOF membranes generally have large pore sizes (>6 Å) as well as high surface areas (>3500 m2/g) and high pore volumes (>1 cm3/g). We finally examined H2/N2 separation potentials of the mixed matrix membranes (MMMs) in which the best MOF materials identified from our high-throughput screening were used as fillers in various polymers. Results showed that incorporation of MOFs into polymers almost doubles H2 permeabilities and slightly enhances H2/N2 selectivities of polymer membranes, which can advance the current membrane technology for efficient H2 purification.

Dataset Information

A Straightforward Method to Prepare MOF-Based Membranes via Direct Seeding of MOF-Polymer Hybrid Nanoparticles.

Publications

A Straightforward Method to Prepare MOF-Based Membranes via Direct Seeding of MOF-Polymer Hybrid Nanoparticles.

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