Woodward-Hoffmann rules in density functional theory: Initial hardness response

Journal of Chemical Physics

Volumn 125, Issue 21, 2006, Pages

  De Proft, Frank ^a   Ayers, Paul W ^b   Fias, Stijn ^a,c   Geerlings, Paul ^a  

^a VRIJE UNIVERSITEIT BRUSSEL   (Belgium)

^b MCMASTER UNIVERSITY   (Canada)

^c GHENT UNIVERSITY   (Belgium)

Author keywords

[No Author keywords available]

Indexed keywords

ADDITION REACTIONS; ETHYLENE; GROUND STATE; HARDNESS; PHOTOCHEMICAL REACTIONS; WAVE EQUATIONS;

DIELS-ALDER CYCLOADDITION; HARDNESS RESPONSE; PERICYCLIC REACTIONS; PROTOTYPICAL PERICYCLIC; WOODWARD-HOFFMANN RULES;

PROBABILITY DENSITY FUNCTION;

EID: 33845441691     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2387953     Document Type: Article

References (74)

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