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Computation of indirect nuclear spin-spin couplings with reduced complexity in pure and hybrid density functional

Arne Luenser1, Jörg Kussmann1, Christian Ochsenfeld1

  • 1Chair of Theoretical Chemistry, Department of Chemistry, University of Munich (LMU Munich) and Center for Integrated Protein Science Munich (CIPSM, LMU Munich), Butenandtstr. 5-13, D-81377 Munich, Germany.

The Journal of Chemical Physics
|October 27, 2016
PubMed

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