Seniority and orbital symmetry as tools for establishing a full configuration interaction hierarchy

Journal of Chemical Physics

Volumn 135, Issue 4, 2011, Pages

  Bytautas, Laimutis ^a   Henderson, Thomas M ^a   Jiménez Hoyos, Carlos A ^a   Ellis, Jason K ^a   Scuseria, Gustavo E ^a  

^a RICE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CONVERGENCE RATES; CORRELATION EFFECT; FULL CONFIGURATION INTERACTION; FUNCTION CONSTRUCTION; HILBERT SUBSPACE; HUBBARD HAMILTONIANS; HYDROGEN CHAINS; MODEL HAMILTONIANS; MOLECULAR SYSTEMS; NEON ATOMS; ORBITAL SYMMETRIES; ORBITALS; QUANTUM NUMBERS; SPATIAL SYMMETRY; SYMMETRY CONSTRAINTS; UNPAIRED ELECTRONS;

BERYLLIUM; CARBON DIOXIDE; DISSOCIATION; HELIUM; NEON; WAVE FUNCTIONS;

HAMILTONIANS;

EID: 79961096874     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3613706     Document Type: Article

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