Irreducible charge density matrices for analysis of many-electron wave functions

International Journal of Quantum Chemistry

Volumn 102, Issue 5 SPEC. ISS., 2005, Pages 582-601

  Luzanov, A V ^a   Prezhdo, O V ^b  

^a INSTITUTE FOR SINGLE CRYSTALS   (Ukraine)

^b UNIVERSITY OF WASHINGTON   (United States)

Author keywords

Atomic valence; CI excited states; Contracted Schr dinger equation; Cumulant densities; Full CI; Multicenter bond indices

Indexed keywords

CHEMICAL BONDS; CHEMICAL REACTIONS; ELECTRONIC STRUCTURE; MAGNETISM; MATRIX ALGEBRA; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; QUANTUM THEORY;

ATOMIC VALENCE; CONFIGURATION INTERACTION EXCITED STATES; CONTRACTED SCHRÖDINGER EQUATION; CUMULANT DENSITIES; FULL CONFIGURATION INTERACTION; MULTICENTER BOND INDICES;

ELECTRON ENERGY ANALYZERS;

EID: 17644400156     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.20438     Document Type: Article

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