2022
DOI: 10.1002/slct.202103725
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The Investigation of Hydrogen Adsorption in MOF NU‐1501 with Different Metal Doping using Molecular Simulations

Abstract: Metal‐organic frameworks with high surface areas are currently being widely used for in‐depth studies on hydrogen storage with the aim of discussing the difficulties created by environmental degradation caused by the burning of fossil fuels. Understanding the effect of varied metal ion doping on adsorption position and energy is crucial to understanding the adsorption process. The adsorption behavior of NU‐1501‐Al and NU‐1501‐Fe was investigated using a combination of Grand Canonical Monte Carlo and Density Fu… Show more

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Cited by 2 publications
(2 citation statements)
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“…MOFs was used as heterogeneous catalysts, biological materials, luminescent materials, gas storage & separation substrate, transportable fuels, solar cells and electronic devices, and drug release and biosensing substrates, and adsorbent materials for water treatment. [1][2][3][4][5][6][7][8][9][10][11] One of the most stable MOFs is porphyrin-based MOFs. Porphyrins are stable, hydrophobic compounds that, when combined with high valence metals, can be utilized to make several chemically stable frameworks.…”
Section: Introductionmentioning
confidence: 99%
See 1 more Smart Citation
“…MOFs was used as heterogeneous catalysts, biological materials, luminescent materials, gas storage & separation substrate, transportable fuels, solar cells and electronic devices, and drug release and biosensing substrates, and adsorbent materials for water treatment. [1][2][3][4][5][6][7][8][9][10][11] One of the most stable MOFs is porphyrin-based MOFs. Porphyrins are stable, hydrophobic compounds that, when combined with high valence metals, can be utilized to make several chemically stable frameworks.…”
Section: Introductionmentioning
confidence: 99%
“…MOFs was used as heterogeneous catalysts, biological materials, luminescent materials, gas storage & separation substrate, transportable fuels, solar cells and electronic devices, and drug release and biosensing substrates, and adsorbent materials for water treatment. 1–11…”
Section: Introductionmentioning
confidence: 99%