Exchange correlation energy as a function of the orbital occupancies: Implementation on first principles local orbital methods

International Journal of Quantum Chemistry

Volumn 91, Issue 2 SPEC, 2003, Pages 151-156

  Pou, P ^a   Oszwaldowski R ^a   Vazquez H ^a   Perez R ^a   Flores, F ^a   Ortega, J ^a  

^a UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

Author keywords

Density Functional Theory; Exchange correlation function; Hubbard Hamiltonian; Many body calculations; Orbital occupancy

Indexed keywords

APPROXIMATION THEORY; CORRELATION METHODS; ELECTROSTATICS; GALLIUM NITRIDE; HAMILTONIANS; PROBABILITY DENSITY FUNCTION;

CORRELATION ENERGY;

ELECTRON ENERGY LEVELS;

EID: 0037438853     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.10432     Document Type: Conference Paper

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