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9. Predicting Bond Dissociation Energies of Transition-Metal Compounds by Multiconfiguration Pair-Density Functional Theory and Second-Order Perturbation Theory Based on Correlated Participating Orbitals and Separated Pairs. Bao JL; Odoh SO; Gagliardi L; Truhlar DG J Chem Theory Comput; 2017 Feb; 13(2):616-626. PubMed ID: 28001390 [TBL] [Abstract][Full Text] [Related]
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