Electronic and Nuclear Fluxes during Pericyclic Reactions: Quantum Simulations for the Cope Rearrangement of Semibullvalene

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Author:Timm Bredtmann, Falko Marquardt, Dirk Andrae, Ingo Barth, Hans-Christian Hege, Kunihito Hoki, Anatol Kenfack, Hirohiko Kono, Jörn Manz, Beate Paulus
Document Type:Other
Publisher:International Symposium on Theoretical and Computational Chemistry, 28 Feb – 2 March, 2010, Max-Planck-Institut für Kohlenforschung, Mülheim an der Ruhr, Germany
Year of first publication:2010
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