Campus Units

Chemistry

Document Type

Article

Publication Version

Published Version

Publication Date

10-2002

Journal or Book Title

Journal of Physical Chemistry A

Volume

106

Issue

46

First Page

11347

Last Page

11353

DOI

10.1021/jp0214108

Abstract

The effect of various substituents on the hydrolysis and condensation reactions, the initial stages of the mechanism to form silsesquioxanes, are investigated with ab initio electronic structure theory including electron correlation effects. In addition, the role of water molecules on the mechanism is also discussed.

Comments

Reprinted (adapted) with permission from Journal of Physical Chemistry A 106 (2002): 11347, doi:10.1021/jp0214108. Copyright 2002 American Chemical Society.

Copyright Owner

American Chemical Society

Language

en

File Format

application/pdf

Included in

Chemistry Commons

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