• Title/Summary/Keyword: chemical functionalization

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Carbon Nanotubes Doped with Nitrogen, Pyridine-like Nitrogen Defects, and Transition Metal Atoms

  • Mananghaya, Michael R.
    • Journal of the Korean Chemical Society
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    • v.56 no.1
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    • pp.34-46
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    • 2012
  • Dopants and defects can be introduced as well as the intercalation of metals into single wall carbon nanotubes (SWCNTs) to modify their electronic and magnetic properties, thus significantly widening their application areas. Through spinpolarized density functional theory (DFT) calculations, we have systemically studied the following: (i) (10,0) and (5,5) SWCNT doped with nitrogen ($CN_xNT$), (ii) (10,0) and (5,5) SWCNT with pyridine-like defects (3NV-$CN_xNT$), and (iii) chemical functionalization of (10,0) and (5,5) 3NV-$CN_xNT$ with 12 different transition metals (TMs) (Sc, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Zn, Pd, and Pt). Attention was done in searching for the most stable configurations, deformation, calculating the formation energies, and exploring the effects of the doping concentration of nitrogen and pyridine-like nitrogenated defects on the electronic properties of the nanotubes. Also, calculating the corresponding binding energies and effects of chemical functionalization of TMs on the electronic and magnetic properties of the nanotubes has been made. We found out that the electronic properties of SWCNT can be effectively modified in various ways, which are strongly dependent not only on the concentration of the adsorbed nitrogen but also to the configuration of the adsorbed nitrogen impurities, the pyridine-like nitrogenated defects, and the TMs absorbed; due to the strong interaction between the d orbitals of TMs and the p orbitals of N atoms, the binding strengths of TMs with the two 3NV-$CN_xNT$ are significantly enhanced when compared to the pure SWCNTs.

2D-Covalent organic frameworks for bioimaging and therapeutic applications

  • Chanho Park;Dong Wook Kim
    • Journal of Radiopharmaceuticals and Molecular Probes
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    • v.6 no.2
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    • pp.171-176
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    • 2020
  • Covalent organic frameworks (COFs) are porous crystalline polymers in which organic units are linked by covalent bonds and have a regular arrangement at the atomic level. Recently, the COFs have been much attention in bio-medical area such as bio-imaging, drug delivery, and therapeutics. These 2D nanoparticles are proving their value in nanomedicine due to their large surface area, functionalization through functional groups exposed on the surface, chemical stability due to covalent bonding, and high biocompatibility. The high ω-electron density and crystallinity of COFs makes it a promising candidate for bioimaging probes, and its porosity and large surface area make it possible to be utilized as a drug delivery vehicle. However, the low dispersibility in water, the cytotoxicity problems of COFs are still challenged to be solved in the future. In this regard, several efforts that increase the degree of dispersion through functionalization on the surface of COFs for the application to the biomedical field have been reported. In this review, we would like to describe the advantages and limitations of COFs for bio-imaging and anti-cancer treatment.

Polymer materials for enzyme immobilization and their application in bioreactors

  • Fang, Yan;Huang, Xiao-Jun;Chen, Peng-Cheng;Xu, Zhi-Kang
    • BMB Reports
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    • v.44 no.2
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    • pp.87-95
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    • 2011
  • Enzymatic catalysis has been pursued extensively in a wide range of important chemical processes for their unparalleled selectivity and mild reaction conditions. However, enzymes are usually costly and easy to inactivate in their free forms. Immobilization is the key to optimizing the in-service performance of an enzyme in industrial processes, particularly in the field of non-aqueous phase catalysis. Since the immobilization process for enzymes will inevitably result in some loss of activity, improving the activity retention of the immobilized enzyme is critical. To some extent, the performance of an immobilized enzyme is mainly governed by the supports used for immobilization, thus it is important to fully understand the properties of supporting materials and immobilization processes. In recent years, there has been growing concern in using polymeric materials as supports for their good mechanical and easily adjustable properties. Furthermore, a great many work has been done in order to improve the activity retention and stabilities of immobilized enzymes. Some introduce a spacer arm onto the support surface to improve the enzyme mobility. The support surface is also modified towards biocompatibility to reduce non-biospecific interactions between the enzyme and support. Besides, natural materials can be used directly as supporting materials owning to their inert and biocompatible properties. This review is focused on recent advances in using polymeric materials as hosts for lipase immobilization by two different methods, surface attachment and encapsulation. Polymeric materials of different forms, such as particles, membranes and nanofibers, are discussed in detail. The prospective applications of immobilized enzymes, especially the enzyme-immobilized membrane bioreactors (EMBR) are also discussed.

Influence of Alkylation on Interface and Thermal Conductivity of Multi-walled Carbon Nanotubes-reinforced Epoxy Resin (알킬화가 다중벽탄소나노튜브로 강인화된 에폭시수지의 계면 및 열전도도에 미치는 영향)

  • Heo, Gun-Young;Rhee, Kyong-Yop;Park, Soo-Jin
    • Polymer(Korea)
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    • v.35 no.6
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    • pp.548-552
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    • 2011
  • Two functionalization methods, i.e., acid treatment and chemical amidation were performed to prepare the functionalized multi-walled carbon nanotubes (MWCNT), and the properties of epoxy/functionalized MWCNT composites were investigated and compared. Fourier transform infrared spectroscopy (FTIR) was used to confirm the surface functionality of the MWCNT obtained by the functionalization methods. The effects of the MWCNT functionalization on the interface and thermal conductivity were studied by zeta potential analyzer, scanning electron microscope and thermal conductivity analyzer. From these results, it was confirmed that the thermal conductivity of the epoxy/MWCNT composites could be increased by grafting with dodecylamine. This could be interpreted by relatively strong dispersion forces of the grafting MWCNT with dodecylamine in DGEBF epoxy resin. These results were in good agreement with the results that the zeta potential value of the grafting MWCNT with dodecylamine has a higher negative value than that of MWCNT with acid treatment.