@article { ISI:000255728500004, title = {Efficient route towards the covalent functionalization of single walled carbon nanotubes}, journal = {Applied Surface Science}, volume = {254}, number = {16}, year = {2008}, month = {JUN}, pages = {4936-4943}, publisher = {ELSEVIER SCIENCE BV}, type = {Article}, address = {PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS}, abstract = {

A simple and efficient method of chemical functionalization of both single and multiwalled carbon nanotubes has been discussed to give enhanced water solubility by rapidly and efficiently generating an appreciable amount of hydrophilic functional groups using microwave radiation. Surface functionalization containing more than 30 wt\% of oxygen has been achieved, resulting into solubility of 2-5 mg/mL. Further covalent functionalization of such soluble SWNTs provides a remarkable degree of aniline functionalization through amidation, where the formation of polyaniline has been avoided. Functionalization of SWNTs is confirmed by techniques like electron microscopy, Fourier transform infrared spectroscopy, thermogravimetry, Raman spectroscopy, cyclic voltammetry and impedance spectroscopy. Electrochemical analysis suggests an enhanced double layer capacitance (similar to 110 F/g) of nanotubes after microwave treatment. Aniline functionalization of SWNTs shows possible variations on the nanotube topography with concomitant formation of a dynamic polymer layer on the nanotube surface. (C) 2008 Elsevier B.V. All rights reserved.

}, keywords = {Carbon nanotubes, Functionalization, Microwave, solubility}, issn = {0169-4332}, doi = {10.1016/j.apsusc.2008.01.148}, author = {Kakade, Bhalchandra A. and Pillai, Vijayamohanan K.} } @article { ISI:000260776600007, title = {Functionalization of single-walled carbon nanotubes with azides derived from amino acids using click chemistry}, journal = {Journal of Nanoscience and Nanotechnology}, volume = {8}, number = {7}, year = {2008}, month = {JUL}, pages = {3351-3356}, publisher = {AMER SCIENTIFIC PUBLISHERS}, type = {Article}, address = {25650 NORTH LEWIS WAY, STEVENSON RANCH, CA 91381-1439 USA}, abstract = {

Single-walled carbon nanotubes (SWCNTs) were chemically functionalized with amino acid-based moieties. The covalent functionalization of alkyne-derived SWCNTs with well defined azides derived from amino acids was accomplished through Cu(I)-catalyzed Huisgen [3+2] dipolar cycloaddition click chemistry. Transmission electron microscopy, Raman spectroscopy, and infrared spectroscopic measurements confirmed the functionalization of SWCNTs by organic molecules derived from amino acids, and the resulting material showed some good solubility in the organic solvents such as tetrahydrofuran, CH2Cl2, and CHCl3.

}, keywords = {Amino acids, Carbon nanotubes, Click chemistry, Functionalization}, issn = {1533-4880}, doi = {10.1166/jnn.2008.109}, author = {Kumar, Indresh and Rana, Sravendra and Rode, Chandrashakher V. and Cho, Jae Whan} } @article { ISI:000265186800069, title = {Assembly of gold nanoparticles on single-walled carbon nanotubes by using click chemistry}, journal = {Journal of Nanoscience and Nanotechnology}, volume = {9}, number = {5}, year = {2009}, month = {MAY}, pages = {3261-3263}, publisher = {AMER SCIENTIFIC PUBLISHERS}, address = {25650 NORTH LEWIS WAY, STEVENSON RANCH, CA 91381-1439 USA}, abstract = {

Azide moiety-functionalized gold nanoparticles were conjugated with acetylene functionalized single-walled carbon nanotubes by employing copper-catalyzed Huisgen{\textquoteright}s [3+2] dipolar cycloaddition {\textquoteleft}click chemistry{\textquoteright} reaction. Evidences of conjunction were observed by TEM, EDX and Raman images.

}, keywords = {Carbon nanotubes, Click chemistry, Functionalization, Nanoparticles}, issn = {1533-4880}, doi = {10.1166/jnn.2009.035}, author = {Rana, Sravendra and Kumar, Indresh and Yoo, Hye Jin and Cho, Jae Whan} } @article { ISI:000296933200001, title = {Solvent-free coumarin synthesis via pechmann reaction using solid catalysts}, journal = {Microporous and Mesoporous Materials}, volume = {149}, number = {1}, year = {2012}, month = {FEB}, pages = {1-9}, publisher = {ELSEVIER SCIENCE BV}, address = {PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS}, abstract = {

A solvent-free versatile and efficient methodology, reported here, allows the synthesis of coumarin by hydroxyalkylation of phenols with ethyl or methyl acetoacetate (via Pechmann reaction) using trifluoromethanesulfonic acid (trifle acid) functionalised Zr-TMS (Zr-TMS, zirconia based transition metal oxide mesoporous molecular sieves) catalysts with different loadings of triflic acid over Zr-TMS (5-25 wt.\%) where the total acid strength of acid functionalised Zr-TMS material is increased as increasing loading of triflic acid from 5 to 25 wt.\% leading to correspond increased higher catalytic activity. (C) 2011 Elsevier Inc. All rights reserved.

}, keywords = {Coumarin, Ethyl acetoacetate, Functionalization, Pechmann reaction, Resorcinol, Zr-TMS}, issn = {1387-1811}, doi = {10.1016/j.micromeso.2011.08.004}, author = {Kalita, Pranjal and Kumar, Rajiv} } @article {46043, title = {New insights into surface functionalization and preparation methods of MWCNT based semiconductor photocatalysts}, journal = {Ceramics International}, volume = {45}, year = {2019}, month = {AUG }, pages = {14490-14499}, type = {Article}, abstract = {

The manuscript primarily describes the influence of various synthesis strategies on the photocatalytic properties of MWCNT/TiO2 binary nanohybrids. The multiwalled carbon nanotube modified titania hybrids synthesized via two-step reaction involving the covalent functionalization with green and mild oxidizing agent like H2O2, followed by simple surfactant/template free hydrothermal synthesis exhibited the maximum photocatalytic efficiency. The Total Organic Carbon (TOC) analysis showed complete mineralization of the persistent Rhodamine B dye in about 8 h. These synthesized nanohybrids in varying MWCNT content were tested for their photocatalytic efficiency in the degradation of explosive effluents like 4-nitrophenol and picric acid. The UV-Vis diffuse reflectance spectroscopy (UV-Vis DRS), X-ray photoelectron spectroscopy (XPS), Brunauer Emmett Teller Surface area analysis (BET), Fourier transform infrared spectroscopy (FT-IR), Transmission electron microscopy (TEM) and Raman spectra analysis evidently revealed the effective synergistic interaction between the MWCNT and titania at the interface that has contributed to the significant enhancement of photocatalytic performance.

}, keywords = {Functionalization, Multiwalled carbon nanotubes (MWCNTs), Nitrophenol (4-NP), Photocatalysis, Picric acid (PA), Rhodamine B (RhB), Sol gel and hydrothermal method, synergistic effects, Titania (TiO2), Total organic carbon content (TOC)}, issn = {0272-8842}, doi = {10.1016/j.ceramint.2019.04.058}, author = {Joseph, Honey Mary and Sugunan, S. and Gurrala, Lakshmiprasad and Mohan, Mothi Krishna and Gopi, Soumya} } @article {48258, title = {Functionalized Mo2BX2 (X = H, OH, O) MBenes as a promising sensor, capturer and storage material for environmentally toxic gases: A case study of 1T and 2H phase}, journal = {Applied Surface Science}, volume = {615}, year = {2023}, month = {APR }, pages = {156299}, type = {Article}, abstract = {

MBenes analogous to MXenes, exfoliated from the bulk MAB phase (M = transition metal, A = IIIA and IVA group, and B = boron) have appeared as promising two dimensional (2D) materials due to their intriguing properties. Here, we report the 2D 1T-2H-phase of Mo2B with their functionalized derivatives Mo2BX2 (X= H, OH, O) and investigate their structural, electronic, and adsorption behavior of toxic gases using the first-principles calculations. This study finds that pristine and functionalized MBenes have dynamic and thermal stability and possess metallic nature in both phases. Based on adsorption behavior and comparison with other 2D materials, we find that pristine MBenes are a desirable adsorbent for NO2, SO2, and CO2 capture. In contrast, the moderate adsorption energies for functionalized MBenes-NH3 systems reveal good sensitivity for NH3 gas detection in both phases. In particular, 2H-Mo2BH2 has higher CT (-0.11e) and appropriate adsorption energy (-0.30 eV), leads a shorter recovery time. Further, DOS calculations reveal that the electrical conducting behavior of MBenes makes them suitable for NH3 detection with a short recovery time. Our results would provide the first insight into the surface-functionalized effect on the structural and electronic properties of the MBenes, and shed light on the application of MBenes for the sensing and catalyst of typical toxic and greenhouse gases, respectively.

}, keywords = {Adsorption energy, First-principles study, Functionalization, Gas sensing, MBenes}, issn = {0169-4332}, doi = {10.1016/j.apsusc.2022.156299}, author = {Shukla, Aarti and Sharma, Gautam and Krishnamurty, Sailaja} } @article {49962, title = {Ionic liquid driven Refined functionalization of graphene oxide: An insight via combined experiments and theory}, journal = {Carbon}, volume = {243}, year = {2025}, month = {AUG}, pages = {120571}, type = {Article}, abstract = {

Functionalizing graphene and its derivative, or doping them with heteroatoms can significantly enhance their optoelectronic, photonic and bio-photonic properties; but controlled and tuneable functionalization of GO is still in their infancy. Herein, a series of functionalized graphene oxide (FGO) are synthesized solvothermally by using task specific ionic liquids (ILs) of varying alkyl chain length; 1-alkyl-3-methylimidazolium tetra fluoroborate, [Cnmim]BF4 (n = 2, 4 etc.). ILs are not only used as a solvent but also as source of fluoride ion for functionalization of GO. A drastic decrease in the oxygen containing functional groups of GO upon fluorination is evidenced by FTIR, Raman, XPS, EDX analysis and electrochemical study. Solid state 19F NMR spectroscopy indicates that, fluorination happens exclusively in edge positions, not on basal planes. Band gap of FGOs decreases along with increasing the chain length of ILs. Further, intense blue emission and high photocatalytic efficiency, using crystal violet as model dye are observed for all the FGOs under visible light. The tailored functionalization by varying alkyl chain length of IL has been rationalized by DFT calculations. It has been realized that owing to the ease of dissociation for [Cnmim]BF4 complexes with n \>= 10; greater extent of fluorination/functionalization of GO has been observed. Elimination of a non-covalent interaction on increasing the alkyl chain length has been attributed for lower stability of higher chain length IL which in turn renders ease of dissociation. Easy yet controlled functionalization of GO using tuneable ILs can open a new direction in the environment friendly synthesis and applications.

}, keywords = {fluorination, Functionalization, graphene oxide, ionic liquids, Luminescence, Photocatalysis}, issn = {0008-6223}, doi = {10.1016/j.carbon.2025.120571}, author = {Kewat, Heera Lal and Dutta, Debangkana and Ajithkumar, T. G. and Chavda, Dhruvil and Sharma, Rahul Kumar and Tiwari, Mrityunjay K. and Sidiqi, Ubaid and Manna, Moutusi and Nigam, Sandeep and Ghosh, Pushpal} }