The role of electron correlations in the binding properties of Ca, Sr, and Ba

Journal of Physics Condensed Matter

Volumn 22, Issue 27, 2010, Pages

  Belger, Dennis ^a   Hüsges, Zita ^a   Voloshina, Elena ^a   Paulus, Beate ^a  

^a FREIE UNIVERSITÄT BERLIN   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

BASIS SETS; BINDING PROPERTIES; BULK MODULUS; COHESIVE ENERGIES; DENSITY FUNCTIONAL THEORY CALCULATIONS; EXPERIMENTAL DATA; HARTREE-FOCK; HARTREE-FOCK CALCULATIONS; HARTREE-FOCK LEVELS; INFINITE SYSTEM; PERIODIC SYSTEM; PSEUDOPOTENTIALS; RELATIVISTIC EFFECTS; SCALAR-RELATIVISTIC EFFECTS;

BARIUM; BARIUM COMPOUNDS; BINDING ENERGY; CALCIUM; CORRELATION METHODS; ELECTRONIC STRUCTURE; MOLECULAR PHYSICS;

DENSITY FUNCTIONAL THEORY;

BARIUM; CALCIUM; METAL; STRONTIUM;

ALGORITHM; ARTICLE; CHEMISTRY; COMPUTER PROGRAM; COMPUTER SIMULATION; ELECTRON; METHODOLOGY; PHYSICS; PRESSURE;

ALGORITHMS; BARIUM; CALCIUM; COMPUTER SIMULATION; ELECTRONS; METALS; PHYSICS; PRESSURE; SOFTWARE; STRONTIUM;

EID: 77955934446     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/22/27/275504     Document Type: Article

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