Nonspherical model density matrices for Rung 3.5 density functionals

Journal of Chemical Physics

Volumn 136, Issue 2, 2012, Pages

  Janesko, Benjamin G ^a   Aguero, Austin ^b  

^a TEXAS CHRISTIAN UNIVERSITY   (United States)

^b ANGELO STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BAND GAPS; DENSITY FUNCTIONALS; DENSITY MATRIX; EMPIRICAL DENSITY; EXCHANGE-CORRELATION FUNCTIONALS; FUNCTIONALS; MOLECULAR THERMOCHEMISTRY; NEW MODEL; NON-SPHERICAL MODEL; NONLOCAL; REFERENCE SYSTEMS; TOTAL ENERGY;

CONJUGATED POLYMERS; FUNCTIONAL POLYMERS; MATRIX ALGEBRA; QUANTUM THEORY; THERMOCHEMISTRY;

DENSITY FUNCTIONAL THEORY;

EID: 84855959243     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3675681     Document Type: Article

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