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Computational organometallic chemistry

Author: Olaf Wiest; Yundong Wu
Publisher: Berlin ; New York : Springer, ©2012.
Edition/Format:   eBook : Document : EnglishView all editions and formats
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This snapshot of state-of-the-art computational studies provides an overview of the vast field of computational organometallic chemistry. It features experts from Europe, Asia and the US that write  Read more...

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Genre/Form: Electronic books
Additional Physical Format: Printed edition:
Material Type: Document, Internet resource
Document Type: Internet Resource, Computer File
All Authors / Contributors: Olaf Wiest; Yundong Wu
ISBN: 9783642252587 3642252583 3642252575 9783642252570
OCLC Number: 779937389
Description: 1 online resource (vii, 254 pages)
Contents: DFT Studies on Zirconium-Mediated Reactions.- Computational Organometallic Chemistry with Force Fields.- New insights onto the molecular mechanism of H2 activation.- Transition Metal-Catalyzed Hydrogenations.- Mechanistic insights into selective oxidation of light alkanes by transition metal compounds/complexes.- Computational Studies on Osmium Catalyzed Olefin Oxidation Reactions.- Reactivity of Metal Carbene Clusters PtnCH2+ and PtMCH2+ (M=Cu, Ag, Au, Pt, Rh) toward O2 and NH3: A Computational Study.- Cobalt Catalyzed Hydroformylation and Cobalt Carbonyl Clusters: Recent Computational Studies.
Responsibility: Olaf Wiest, Yundong Wu, editors.

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