• Title/Summary/Keyword: Metal-Organic frameworks

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CO2 Adsorption in Metal-organic Frameworks (금속유기구조체를 이용한 이산화탄소 흡착 연구)

  • Kim, Jun;Kim, Hee-Young;Ahn, Wha-Seung
    • Korean Chemical Engineering Research
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    • v.51 no.2
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    • pp.171-180
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    • 2013
  • Metal organic frameworks (MOFs) are a class of crystalline organic-inorganic hybrid compounds formed by coordination of metal clusters or ions with organic linkers. MOFs have recently attracted intense research interest due to their permanent porous structures, large surface areas and pore volume, high-dispersed metal species, and potential applications in gas adsorption, separation, and catalysis. $CO_2$ adsorption in MOFs has been investigated in two areas of $CO_2$ storage at high pressures and $CO_2$ adsorption at atmospheric pressure conditions. In this short review, $CO_2$ adsorption/separation results using MOFs conducted in our laboratory was explained in terms of four contributing effects; (1) coordinatively unsaturated open metal sites, (2) functionalization, (3) interpenetration/catenation, and (4) ion-exchange. Zeolitic imidazolate frameworks (ZIFs) and covalent organic frameworks (COFs) were also considered as a candidate material.

A Density Functional Theory Study on a Series of Functionalized Metal-Organic Frameworks (작용기를 치환한 Metal-Organic Frameworks 에 대한 DFT 연구)

  • Kim Dae Jin;Lee Tae Beom;Choi Seung Hun;Lee Eun Seong;Oh Yu Jin;Hye Ji Hye;Kim Ja Heon
    • 한국전기화학회:학술대회논문집
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    • 2005.07a
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    • pp.329-334
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    • 2005
  • In order to find out rational design and synthetic strategies toward efficient hydrogen storage materials, we performed quantum mechanical calculations on a series of the Metal-Organic Frameworks (MOFs) containing functionalized organic linkers. Based on the shape of frontier orbitals and the electrostatic potential map of various MOFs from density functional theory calculations, it was found that the delocalization of electron and asymmetric polarization of the organic linker play an important role in the hydrogen storage capacity of Metal-Organic Frameworks. The prediction of the modeling study could be supported by the hydrogen adsorption experiments using MOF-5 and amine substituted MOF-5, which showed more enhanced hydrogen storage capacity of amine substituted MOF-5 compared with that of MOF-5.

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Understanding the Mechanism of Hydrogen Adsorption into Metal Organic Frameworks (Metal-Organic Framework의 수소 흡착 메커니즘의 이해)

  • Lee, Tae-Bum;Kim, Dae-Jin;Yoon, Ji-Hye;Choi, Sang-Beom;Kim, Ja-Heon;Choi, Seung-Hoon
    • 한국신재생에너지학회:학술대회논문집
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    • 2005.11a
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    • pp.634-637
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    • 2005
  • Hydrogen adsorption mechanism onto the porous metal-organic frameworks (MOFs) has been studied by density functional theory calculation. The selected functionals for the predict ion of interact ion energies between hydrogen and potential adsorption sites of MOF was utilized after the evaluation with the various functionals for interaction energy of $H_2C_6H_6$ model system the adsorption energy of hydrogen molecule into MOF was investigated with the consideration of the favorable adsorption sites and the orientations. We also calculated the second favorable adsorption sites by geometry optimization using every combination of two first absorbed hydrogen molecules. Based on the calculation of first and second adsorption sites and energies, the hydrogen adsorption into MOF follows a cooperative mechanism in which the initial metal sites initiate the propagation of the hydrogen adsorption on the whole frameworks. In addition, it was found that the interaction strength between the simple benzene ring with hydrogen is significantly reinforced when the benzene ring has been incorporated into the framework of MOFs.

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Adsorptive Removal of Hazardous Organics from Water with Metal-organic Frameworks (금속-유기 골격체(Metal-organic Frameworks)를 활용한 물로부터의 유해 유기물의 흡착 제거)

  • Seo, Pill Won;Song, Ji Yoon;Jhung, Sung Hwa
    • Applied Chemistry for Engineering
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    • v.27 no.4
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    • pp.358-365
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    • 2016
  • Removing hazardous materials from water resources is very important for efficient utilization of the resources, and adsorptive removal is regarded as a competitive technology when good adsorbents with high capacity/selectivity are available. Metal-organic framework (MOF), composed of both organic and inorganic (metallic) species, have been tried for various adsorptions because of huge surface area/pore volume, well-defined pore structure, and facile functionalization. In this review, we summarized technologies on adsorptive removal of hazardous organics from water mainly using MOFs as adsorbents. Instead of reporting high adsorption capacity or rate, we summarized mechanisms of interaction between adsorbates (organics) and adsorbents (MOFs) and methods to modify or functionalize MOFs for effective adsorptions. We expect for readers of this review to understand needed characteristics of adsorbents for the adsorptive removal, functionalization of MOFs for effective adsorption and so on. Moreover, they might have an idea on storage and delivery of organics via understanding of the mechanism of adsorption and interaction.

Hydrogen Storage Behaviors of Carbon Nanotubes/Metal-organic Frameworks-5 Hybrid Composites

  • Park, Soo-Jin;Lee, Seul-Yi
    • Carbon letters
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    • v.10 no.1
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    • pp.19-22
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    • 2009
  • In this work, the hydrogen storage behaviors of carbon nanotubes (CNTs)/metal-organic frameworks-5 (MOF-5) hybrid composites (CNTs/MOF-5) were studied. Hydrothermal synthesis of MOF-5 was conducted by conventional convection heating using 1-methyl-2-pyrrolidone (NMP) as a solvent. Morphological characteristics and average size of the CNTs/MOF-5 were also obtained using a scanning electron microscopy (SEM). The pore structure and specific surface area of the CNTs/MOF-5 were analyzed by N2/77 K adsorption isotherms. The capacity of hydrogen storage of the CNTs/MOF-5 was investigated at 298 K/100 bar. As a result, the CNTs/MOF-5 had crystalline structures which were formed by hybrid synthesis process. It was noted that the CNTs/MOF-5 can be potentially encouraging materials for hydrogen adsorption and storage applications at room temperature.

Revolutionizing Energy Storage: Exploring Processing Approaches and Electrochemical Performance of Metal-Organic Frameworks (MOFs) and Their Hybrids

  • Wajahat Khalid;Muhammad Ramzan Abdul Karim;Mohsin Ali Marwat
    • Journal of Electrochemical Science and Technology
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    • v.15 no.1
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    • pp.14-31
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    • 2024
  • The text highlights the growing need for eco-friendly energy storage and the potential of metal-organic frameworks (MOFs) to address this demand. Despite their promise, challenges in MOF-based energy storage include stability, reproducible synthesis, cost-effectiveness, and scalability. Recent progress in supercapacitor materials, particularly over the last decade, has aimed to overcome these challenges. The review focuses on the morphological characteristics and synthesis methods of MOFs used in supercapacitors to achieve improved electrochemical performance. Various types of MOFs, including monometallic, binary, and tri-metallic compositions, as well as derivatives like hybrid nanostructures, sulfides, phosphides, and carbon composites, are explored for their energy storage potential. The review emphasizes the quest for superior electrochemical performance and stability with MOF-based materials. By analyzing recent research, the review underscores the potential of MOF-based supercapacitors to meet the increasing demands for high power and energy density solutions in the field of energy storage.

Recent Progress on Adsorptive Removal of Cd(II), Hg(II), and Pb(II) Ions by Post-synthetically Modified Metal-organic Frameworks and Chemically Modified Activated Carbons

  • Rallapalli, Phani Brahma Somayajulu;Choi, Suk Soon;Ha, Jeong Hyub
    • Applied Chemistry for Engineering
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    • v.33 no.2
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    • pp.133-144
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    • 2022
  • Fast-paced industrial and agricultural development generates large quantities of hazardous heavy metals (HMs), which are extremely damaging to individuals and the environment. Research in both academia and industry has been spurred by the need for HMs to be removed from water bodies. Advanced materials are being developed to replace existing water purification technologies or to introduce cutting-edge solutions that solve challenges such as cost efficacy, easy production, diverse metal removal, and regenerability. Water treatment industries are increasingly interested in activated carbon because of its high adsorption capacity for HMs adsorption. Furthermore, because of its huge surface area, abundant functional groups on surface, and optimal pore diameter, the modified activated carbon has the potential to be used as an efficient adsorbent. Metal-organic frameworks (MOFs), a novel organic-inorganic hybrid porous materials, sparked an interest in the elimination of HMs via adsorption. This is due to the their highly porous nature, large surface area, abundance of exposed adsorptive sites, and post-synthetic modification (PSM) ability. This review introduces PSM methods for MOFs, chemical modification of activated carbons (ACs), and current advancements in the elimination of Pb2+, Hg2+, and Cd2+ ions from water using modified MOFs and ACs via adsorption.

Synthesis Strategy for Electrodes and Metal-Organic Frameworks based on Metal Nanoparticle using Flashlight (플래시라이트를 이용한 금속나노입자 기반 전극 및 금속유기골격체 합성 전략)

  • Yim, Changyong;Baek, Saeyeon;Park, Soyeon;Kim, Hamin
    • Applied Chemistry for Engineering
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    • v.31 no.6
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    • pp.591-595
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    • 2020
  • Intensive pulsed light (IPL) technique enables energy to be transferred to a target substance in a short time per millisecond at room temperature under an ambient atmosphere. Due to the growing interest in flashlights with excellent functionality among various technologies, light-sintering research on metal particles using IPL has been carried out representatively. Recently, examples of the application of IPL to various material synthesis have been reported. In the present article, various strategies using IPL including the manufacture of flexible electrodes and the synthesis of metal-organic frameworks were discussed. In particular, the process of improving oxidation resistance and electrical conductivity of electrodes, and also the metal-organic framework synthesis from metal surface were explained in detail. We envision that the review article can be of great help to researchers who investigate electrode manufacturing and material synthesis using IPL.