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Assessment of Density Functionals for Predicting One-Bond Carbon-Hydrogen NMR Spin-Spin Coupling Constants

Sergey N Maximoff1, Juan E Peralta1, Verónica Barone1

  • 1Department of Chemistry, Rice University, Houston, Texas 77005-1892.

Journal of Chemical Theory and Computation
|December 8, 2015
PubMed

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