Exchange and correlation in density functional theory and quantum chemistry

International Journal of Quantum Chemistry

Volumn 111, Issue 3, 2011, Pages 563-569

  Peach, Michael J G ^a,b   Tozer, David J ^a   Handy, Nicholas C ^c  

^a DURHAM UNIVERSITY   (United Kingdom)

^b FREIE UNIVERSITÄT BERLIN   (Germany)

^c UNIVERSITY OF CAMBRIDGE   (United Kingdom)

Author keywords

density functional theory; exchange correlation; molecular dissociation; quantum chemistry

Indexed keywords

DENSITY FUNCTIONALS; DISSOCIATION PROCESS; DYNAMIC CORRELATION; ESSENTIAL ELEMENTS; EXCHANGE AND CORRELATION; EXCHANGE CORRELATIONS; GAUSSIAN ORBITALS; MOLECULAR DISSOCIATION; MOMENTUM FUNCTIONS; POTENTIAL ENERGY CURVES; VALENCE BONDS;

CORRELATION METHODS; DISSOCIATION; POTENTIAL ENERGY; QUANTUM CHEMISTRY; QUANTUM THEORY;

DENSITY FUNCTIONAL THEORY;

EID: 78649854855     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.22442     Document Type: Article

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