Empirical analysis of the Lieb-Oxford bound in ions and molecules

International Journal of Quantum Chemistry

Volumn 108, Issue 13, 2008, Pages 2428-2432

  Odashima, Mariana M ^a   Capelle, K ^a  

^a UNIVERSITY OF SÃO PAULO   (Brazil)

Author keywords

Correlation energy; Density functional theory; Lieb Oxford bound, molecular energies, exchange energy

Indexed keywords

ATOMIC PHYSICS; ATOMS; CONTROL THEORY; CORRELATION METHODS; ELECTROLYSIS; ERROR ANALYSIS; IONIZATION OF LIQUIDS; IONS; LIQUIDS; MOLECULES;

CORRELATION ENERGY; COULOMB INTERACTION ENERGIES; DENSITY FUNCTIONAL THEORY; DENSITY FUNCTIONALS; ELECTRON LIQUIDS; EMPIRICAL ANALYSES; EXCHANGE-CORRELATION ENERGIES; EXCHANGE-CORRELATION FUNCTIONALS; LIEB OXFORD BOUND, MOLECULAR ENERGIES, EXCHANGE ENERGY; LIEB-OXFORD BOUND; LOWER BOUNDS; MANY-ELECTRON SYSTEMS; MOLECULAR SYSTEMS; TO MANY; UNIVERSAL PROPERTIES;

ELECTRONS;

EID: 52449093612     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.21677     Document Type: Conference Paper

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