Collect. Czech. Chem. Commun.
2003, 68, 2309-2321
https://doi.org/10.1135/cccc20032309
Multireference Brillouin-Wigner Coupled Cluster Singles and Doubles (MRBWCCSD) and Multireference Doubles Configuration Interaction (MRD-CI) Calculations for the Bergman Cyclization Reaction
Oscar Rey Puiggrosa, Jiří Pittnera,*, Petr Čárskya,*, Philipp Stampfussb and Wolfgang Wenzelb
a J. Heyrovský Institute of Physical Chemistry, Academy of Sciences of the Czech Republic, Dolejškova 3, 182 23 Prague 8, Czech Republic
b Research Centre Karlsruhe, Institute for Nanotechnology, P.O. Box 3640, D-76021 Karlsruhe, Germany
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