Do independent-particle-model broken-symmetry solutions contain more physics than the symmetry-adapted ones? the case of homonuclear diatomics

Journal of Chemical Physics

Volumn 130, Issue 8, 2009, Pages

  Li, Xiangzhu ^a   Paldus, Josef ^a  

^a UNIVERSITY OF WATERLOO   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; MOLECULAR ORBITALS; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION;

CLOSED SHELLS; CONFIGURATION INTERACTIONS; COUPLED-CLUSTER METHODS; DENSITY-FUNCTIONAL THEORIES; DISSOCIATION LIMITS; HOMONUCLEAR DIATOMICS; INTERNUCLEAR SEPARATIONS; ORBITALS; REALISTIC POTENTIALS; RESTRICTED HARTREE-FOCK; STABILITY PROBLEMS; SYMMETRY-BREAKING;

DENSITY FUNCTIONAL THEORY;

EID: 61449219041     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3078417     Document Type: Article

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