Comparison of intermolecular interaction energies from SAPT and DFT including empirical dispersion contributions

Journal of Physical Chemistry A

Volumn 115, Issue 41, 2011, Pages 11321-11330

  Hesselmann, Andreas ^a  

^a UNIVERSITY OF ERLANGEN NUREMBERG   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

COUPLED CLUSTERS; DAMPING FUNCTION; DISPERSION CONTRIBUTION; DISPERSION CORRECTION; DISPERSION METHODS; INTERACTION ENERGIES; INTERMOLECULAR COMPLEXES; INTERMOLECULAR INTERACTION ENERGIES; LONG RANGE INTERACTIONS; SYMMETRY ADAPTED PERTURBATION THEORY;

COMPLEXATION; DENSITY FUNCTIONAL THEORY; PERTURBATION TECHNIQUES;

DISPERSIONS;

ARTICLE; COMPARATIVE STUDY; QUANTUM THEORY; THERMODYNAMICS;

QUANTUM THEORY; THERMODYNAMICS;

EID: 80054713682     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp205031e     Document Type: Article

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