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Breathing orbital valence bond method in diffusion Monte Carlo: C-H bond dissociation of acetylene

Dominik Domin1, Benoît Braïda, William A Lester

  • 1Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California at Berkeley, Berkeley, California 94720-1460, USA.

The Journal of Physical Chemistry. A
|July 24, 2008
PubMed

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