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Updated: Jul 9, 2026

Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method
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Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method

Published on: July 19, 2019

メチアルミノキサン (MAO) ポリメリゼーションメカニズムとアビニシオ分子ダイナミクスと電子構造計算からの運動モデル

Lacramioara Negureanu1, Randall W Hall, Leslie G Butler

  • 1Department of Chemistry, Louisiana State University, Baton Rouge, LA 70803, USA.

Journal of the American Chemical Society
|December 21, 2006
PubMed
まとめ

メチルアルミノキサン (MAO) は,メタルロケンの触媒に不可欠です. この研究では,分子動力学シミュレーションを用いて,構造単位として[(CH3) Al-O]を構成する二機能モノメアのステップポリメリゼーションによるMAO形態を明らかにしています.

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