Explicit correlation and basis set superposition error: The structure and energy of carbon dioxide dimer

Journal of Chemical Physics

Volumn 135, Issue 15, 2011, Pages

  McMahon, Jordan D ^a   Lane, Joseph R ^a  

^a UNIVERSITY OF WAIKATO   (New Zealand)

Author keywords

[No Author keywords available]

Indexed keywords

AUXILIARY BASIS SETS; BASIS SET SUPERPOSITION ERRORS; CARBON DIOXIDE DIMERS; CCSD; COMPLETE BASIS SET LIMIT; COUPLED-CLUSTER METHODS; COUPLED-CLUSTER SINGLES; GLOBAL MINIMA; INTERACTION ENERGIES; OPTIMIZATION ROUTINE; OPTIMIZED GEOMETRIES; PARALLEL STRUCTURES;

ELECTRIC CIRCUIT BREAKERS; GEOMETRY; NUMERICAL METHODS; OPTIMIZATION; SET THEORY;

CARBON DIOXIDE;

EID: 80155147813     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3653230     Document Type: Article

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