Comment on: "On the accuracy of DFT methods in reproducing ligand substitution energies for transition metal complexes in solution: The role of dispersive interactions" by H. Jacobsen and L. Cavallo

ChemPhysChem

Volumn 13, Issue 6, 2012, Pages 1407-1409

  Grimme, Stefan ^a  

^a UNIVERSITY OF BONN   (Germany)

Author keywords

continuum solvation models; density functional theory; dispersion corrections; metal complexes; thermochemistry

Indexed keywords

METAL COMPLEXES; THERMOCHEMISTRY; TRANSITION METAL COMPOUNDS; TRANSITION METALS;

CONTINUUM SOLVATION MODELS; DFT METHOD; DISPERSION CORRECTION; DISPERSIVE INTERACTIONS; LIGAND SUBSTITUTION;

DENSITY FUNCTIONAL THEORY;

EID: 84859911641     PISSN: 14394235     EISSN: 14397641     Source Type: Journal    
DOI: 10.1002/cphc.201200094     Document Type: Article

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