The calculation of adiabatic-connection curves from full configuration-interaction densities: Two-electron systems

Journal of Chemical Physics

Volumn 130, Issue 10, 2009, Pages

  Teale, A M ^a   Coriani, S ^a,b   Helgaker, T ^a  

^a UNIVERSITY OF OSLO   (Norway)

^b UNIVERSITY OF TRIESTE   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL EFFICIENCY; DENSITY FUNCTIONAL THEORY; ELECTRON-ELECTRON INTERACTIONS; HELIUM; SEMICONDUCTOR QUANTUM DOTS;

ADIABATIC CONNECTIONS; BASIS-SET LIMITS; CHEMICAL TREATMENTS; CONFIGURATION INTERACTIONS; DENSITY-FUNCTIONAL THEORIES; DIRECT OPTIMIZATIONS; ELECTRON INTERACTIONS; ELECTRONIC-STRUCTURE THEORIES; EXCHANGE CORRELATIONS; EXCHANGE-CORRELATION ENERGIES; FUNCTIONALS; H2 MOLECULES; INPUT DATUM; ISO-ELECTRONIC SERIES; ITERATIVE SCHEMES; NATURAL ORBITALS; NUMBER OF ELECTRONS; OPTIMIZATION SCHEMES; SECOND ORDERS; TWO-ELECTRON SYSTEMS; WORK FOCUS;

ELECTRONS;

EID: 62549163816     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3082285     Document Type: Article

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