Excited-state intramolecular proton transfer: A survey of TDDFT and RI-CC2 excited-state potential energy surfaces

Journal of Physical Chemistry A

Volumn 109, Issue 14, 2005, Pages 3201-3208

  Aquino, Adelia J A ^a   Lischka, Hans ^a   Hättig, Christof ^b  

^a UNIVERSITY OF VIENNA   (Austria)

^b KARLSRUHE INSTITUTE OF TECHNOLOGY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRON TRANSFER; EXCITED STATES; PHOTODYNAMICS; PROTON TRANSFER;

ALDEHYDES; AROMATIC HYDROCARBONS; ELECTRON ENERGY LEVELS; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; ORGANIC ACIDS; POTENTIAL ENERGY; PROTONS;

CHARGE TRANSFER;

AROMATIC HYDROCARBON; PROTON;

CHEMICAL MODEL; CHEMISTRY; COMPARATIVE STUDY; COMPUTER SIMULATION; REVIEW;

COMPUTER SIMULATION; HYDROCARBONS, AROMATIC; MODELS, CHEMICAL; PROTONS;

EID: 17444370142     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp050288k     Document Type: Review

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