Necessary conditions for the N-representability of pair distribution functions

International Journal of Quantum Chemistry

Volumn 106, Issue 7, 2006, Pages 1487-1498

  Ayers, Paul W ^a   Davidson, Ernest R ^b,c  

^a MCMASTER UNIVERSITY   (Canada)

^b UNIVERSITY OF WASHINGTON   (United States)

^c University of North Carolina at Chapel Hill   (United States)

Author keywords

Density functional theory; Electron pair density; N representability; Variational principle

Indexed keywords

DENSITY FUNCTIONAL THEORY; ELECTRON PAIR DENSITY; N-REPRESENTABILITY; VARIATIONAL PRINCIPLE;

COMPUTATIONAL METHODS; CONSTRAINT THEORY; ELECTRONS; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; ROBUSTNESS (CONTROL SYSTEMS);

CARRIER CONCENTRATION;

EID: 33646340687     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.20880     Document Type: Article

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