Binding energy curves from nonempirical density functionals. I. Covalent bonds in closed-shell and radical molecules

Journal of Physical Chemistry A

Volumn 109, Issue 48, 2005, Pages 11006-11014

  Ruzsinszky, Adrienn ^a   Perdew, John P ^a   Csonka, Gábor I ^b  

^a Tulane University   (United States)

^b BUDAPEST UNIVERSITY OF TECHNOLOGY AND ECONOMICS   (Hungary)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON; FREE RADICALS; GROUND STATE; HELIUM; HYDROGEN; LITHIUM COMPOUNDS; NITROGEN; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION;

COVALENT BONDS; ENERGY BARRIERS; LOCAL SPIN DENSITY (LSD) APPROXIMATION;

BINDING ENERGY;

EID: 29444437386     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0534479     Document Type: Article

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