Electronic-structure and quantum dynamical study of the photochromism of the aromatic Schiff base salicylideneaniline

Journal of Chemical Physics

Volumn 129, Issue 21, 2008, Pages

  Ortiz Sánchez, Juan Manuel ^a   Gelabert, Ricard ^a   Moreno, Miquel ^a   Lluch, Joś M ^a  

^a UNIVERSITAT AUTÒNOMA DE BARCELONA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRONIC STATES; ELECTRONIC STRUCTURE; EXCITED STATES; POTENTIAL ENERGY; PROTON TRANSFER; QUANTUM CHEMISTRY; QUANTUM THEORY;

CONICAL INTERSECTION; ELECTRONIC ENERGIES; EXCITED ELECTRONIC STATE; EXCITED-STATE INTRAMOLECULAR PROTON TRANSFER; PROTON TRANSFER REACTIONS; SALICYLIDENEANILINE; TIME DEPENDENT DENSITY FUNCTIONAL THEORY; TIME-DEPENDENT DFT;

DENSITY FUNCTIONAL THEORY;

EID: 57449099511     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3032215     Document Type: Article

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