Nonadiabatic molecular dynamics simulations of the energy transfer between building blocks in a phenylene ethynylene dendrimer

Journal of Physical Chemistry A

Volumn 113, Issue 26, 2009, Pages 7535-7542

  Fernandez Alberti, Sebastian ^a   Kleiman, Valeria D ^b   Tretiak, Sergei ^c   Roitberg, Adrian E ^b  

^a UNIVERSIDAD NACIONAL DE QUILMES   (Argentina)

^b University of Florida ^*  (United States)

^c LOS ALAMOS NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BUILDING BLOCK; CONICAL INTERSECTION; ELECTRONIC COUPLING; ENERGETIC PROPERTIES; ENERGY TRANSFER PROCESS; FAST TRANSFER; NON-ADIABATIC COUPLING; NONADIABATIC MOLECULAR DYNAMICS; ON THE FLIES; POLY(PHENYLENE-ETHYNYLENE); QUANTUM TRANSITIONS; TRIPLE BONDS; ULTRA-FAST DYNAMICS; VIBRATIONAL ENERGY TRANSFER;

AROMATIC COMPOUNDS; DENDRIMERS; ENERGY TRANSFER; MOLECULAR DYNAMICS; ORGANIC POLYMERS; PHOTOEXCITATION; POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY;

DYNAMICS;

EID: 67649562189     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp900904q     Document Type: Article

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