Accurate interaction energies at density functional theory level by means of an efficient dispersion correction

Journal of Chemical Physics

Volumn 130, Issue 17, 2009, Pages

  Krishtal, Alisa ^a   Vanommeslaeghe, Kenno ^b   Olasz, András ^c,d   Veszpŕmi, Tamás ^c   Van Alsenoy, Christian ^a   Geerlings, Paul ^d  

^a UNIVERSITY OF ANTWERP   (Belgium)

^b UNIVERSITY OF MARYLAND SCHOOL OF PHARMACY   (United States)

^c BUDAPEST UNIVERSITY OF TECHNOLOGY AND ECONOMICS   (Hungary)

^d VRIJE UNIVERSITEIT BRUSSEL   (Belgium)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC POLARIZABILITY; BASIS SETS; CCSD; COMPLETE BASIS SET LIMITS; DAMPING FUNCTIONS; DISPERSION CORRECTIONS; DISPERSION ENERGIES; DISPERSION INTERACTIONS; EQUILIBRIUM GEOMETRIES; FUNCTIONALS; INTERACTION ENERGIES; LINEAR REGRESSION EQUATIONS; MOLECULAR POLARIZABILITY;

ATOMS; LIGHT WEIGHT ROLLING STOCK; TENSORS;

DENSITY FUNCTIONAL THEORY;

ALGORITHM; ARTICLE; QUANTUM THEORY; SENSITIVITY AND SPECIFICITY; STATISTICAL MODEL; THERMODYNAMICS;

ALGORITHMS; LINEAR MODELS; QUANTUM THEORY; SENSITIVITY AND SPECIFICITY; THERMODYNAMICS;

EID: 65549102172     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3126248     Document Type: Article

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