Symmetry-adapted perturbation theory with Kohn-Sham orbitals using non-empirically tuned, long-range-corrected density functionals

Journal of Chemical Physics

Volumn 140, Issue 4, 2014, Pages

  Lao, Ka Un ^a   Herbert, John M ^a  

^a OHIO STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BENCHMARKING; DIMERS; DISPERSIONS; MOLECULAR PHYSICS; MONOMERS; PERTURBATION TECHNIQUES; POTENTIAL ENERGY;

ACCURATE PREDICTION; ASYMPTOTIC CORRECTION; DENSITY FUNCTIONALS; DISPERSION ENERGIES; INTERMOLECULAR INTERACTIONS; POTENTIAL ENERGY CURVES; SEPARATION PARAMETERS; SYMMETRY ADAPTED PERTURBATION THEORY;

DENSITY FUNCTIONAL THEORY;

EID: 84897845777     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4862644     Document Type: Article

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