Electronic quantum fluxes during pericyclic reactions exemplified for the cope rearrangement of semibullvalene

Journal of Physical Chemistry B

Volumn 115, Issue 18, 2011, Pages 5476-5483

  Andrae, Dirk ^a   Barth, Ingo ^a,c   Bredtmann, Timm ^a   Hege, Hans Christian ^b   Manz, Jörn ^a   Marquardt, Falko ^a,b   Paulus, Beate ^a  

^a FREIE UNIVERSITÄT BERLIN   (Germany)

^b ZUSE INSTITUTE BERLIN   (Germany)

^c MAX BORN INSTITUT   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

LASER SPECTROSCOPY; QUANTUM CHEMISTRY; QUANTUM ELECTRONICS;

ATTOSECONDS; COPE REARRANGEMENT; ELECTRON TRANSFER; ELECTRONIC FLUX; ELECTRONIC QUANTUM; LEWIS STRUCTURE; ORBITALS; PERICYCLIC REACTION; QUANTUM SIMULATIONS; SEMIBULLVALENE; TIME EVOLUTIONS; TIME-RESOLVED SPECTROSCOPY;

ELECTRONS;

EID: 79958192799     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp110365g     Document Type: Article

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