Real size of ligands, reactants and catalysts: Studies of structure, reactivity and selectivity by ONIOM and other hybrid computational approaches☆

Published 2010 View Full Article

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Title
Real size of ligands, reactants and catalysts: Studies of structure, reactivity and selectivity by ONIOM and other hybrid computational approaches☆
Authors
Keywords
-
Journal
JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL
Volume 324, Issue 1-2, Pages 104-119
Publisher
Elsevier BV
Online
2010-03-16
DOI
10.1016/j.molcata.2010.03.015

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