Pristine multiwalled carbon nanotube/polyethylene nanocomposites by immobilized catalysts

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In this work, we achieved the production of pristine multiwalled carbon nanotube (MWCNT)/ polyethylene (PE) composites composed of uniformly dispersed, PE-coated MWCNT strands, by the in situ polymerization of ethylene with Cp2ZrCl2 immobilized onto the sidewalls of pristine MWCNTs as a catalyst. The prepared composites showed a highly increased Young's modulus (359%) as compared to homopolyethylene, due to well-dispersed pristine MWCNTs in the PE matrices. Electronic interactions and binding modes between zirconocenes and CNTs were investigated by theoretical and experimental methods, and both methods indicated that the sidewalls of CNTs could form a coordination bond with the positively charged active species and act as a ligand with strong electron donation.
Publisher
AMER CHEMICAL SOC
Issue Date
2008-07
Language
English
Article Type
Article
Keywords

MOLECULAR-ORBITAL METHODS; MM3 FORCE-FIELD; NANOTUBE-POLYMER COMPOSITES; VALENCE BASIS-SETS; METALLOCENE CATALYSTS; OLEFIN POLYMERIZATION; EFFECT TRANSISTORS; POLYETHYLENE; MECHANICS; ETHYLENE

Citation

CHEMISTRY OF MATERIALS, v.20, no.14, pp.4588 - 4594

ISSN
0897-4756
DOI
10.1021/cm800195h
URI
http://hdl.handle.net/10203/12124
Appears in Collection
CH-Journal Papers(저널논문)
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