An explanation for experimental behavior of hybrid metallocene silica-supported catalyst for ethylene polymerization

This work presents the results of homopolymerization of ethylene using an hybrid system (nBuCp)2ZrCl2-Cp2ZrCl 2, supported on silica. The catalytic systems were analyzed by RBS, DRIFTS and EXAFS and polyethylenes (PE) by GPC and DSC. The catalytic activities and the polymer properties showed depende...

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Bibliographic Details
Authors: Aguiao Rodrigues, Silvia; Silveira, Fernando; dos Santos, J.H.Z.; Ferreira, María Luján
Format: Article
Status:Published version
Publication date:2004
Country:Argentina
Institution:Consejo Nacional de Investigaciones Científicas y Técnicas
Repository:CONICET Digital (CONICET)
Language:English
OAI Identifier:oai:ri.conicet.gov.ar:11336/97832
Online Access:http://hdl.handle.net/11336/97832
Access Level:Open access
Keyword:SUPPORTED METALLOCENES
THEORETICAL CHARACTERIZATION
ZIRCONOCENE
https://purl.org/becyt/ford/2.4
https://purl.org/becyt/ford/2
Description
Summary:This work presents the results of homopolymerization of ethylene using an hybrid system (nBuCp)2ZrCl2-Cp2ZrCl 2, supported on silica. The catalytic systems were analyzed by RBS, DRIFTS and EXAFS and polyethylenes (PE) by GPC and DSC. The catalytic activities and the polymer properties showed dependence on the different ratio used (nBuCp)2ZrCl2/Cp2ZrCl2 at the preparation step. Theoretical studies permit us to conclude that the metallocenes interact with the surface in different ways. Depending on the addition order and the molar ratio between both metallocenes, distribution and nature of active species would be different. Possibility of binuclear active sites with different propagation and termination constants is analyzed and discussed. EHMO calculations allow us to conclude that Cp2ZrCl 2 has a strong affinity by AIS plane, whereas (nBuCp) 2ZrCl2 shows similar affinity for both silica planes.