DFT study of the activation of dimethylzirconocenes by aluminium-containing activators

The participation of two and three A≡ Lewis acid sites in the formation of the catalytic particle Cp * 2ZrMe +A − for olefin polymerization reactions stabilizes it with respect to neutral precursor Cp * 2ZrMe 2 and AlMe 2X, and decreases the energy of heterolysis, i.e., complete spatial separation o...

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Bibliographic Details

Published in:	Mendeleev communications Vol. 20; no. 5; pp. 266 - 268
Main Authors:	Ustynyuk, Leila Yu, Fushman, Elga A., Lalayan, Svetlana S.
Format:	Journal Article
Language:	English
Published:	Elsevier B.V 01-09-2010
Subjects:	Activation Activation analysis Catalytic activity Energy of formation Lewis acid Olefins Polymerization Precursors
Online Access:	Get full text
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