Theoretical study of photochromic compounds. 1. Bond length alternation and absorption spectra for the open and closed forms of 29 diarylethene derivatives

Journal of Physical Chemistry A

Volumn 113, Issue 29, 2009, Pages 8409-8414

  Patel, Pansy D ^a   Masunov, Artem E ^a  

^a UNIVERSITY OF CENTRAL FLORIDA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION WAVELENGTHS; BOND LENGTH ALTERNATION; CLOSED FORM; DATA STORAGE; DIARYLETHENE; DIARYLETHENE DERIVATIVES; EXCHANGE-CORRELATION FUNCTIONALS; GEOMETRY OPTIMIZATION; ISOMERIC FORMS; MOLECULAR GEOMETRIES; OPTICAL SWITCHING; PHOTOCHROMIC COMPOUND; PHOTOCYCLIZATION; SOLVENT EFFECTS; SPECTRAL PARAMETERS; THEORETICAL STUDY; TIME DEPENDENT DENSITY FUNCTIONAL THEORY;

ABSORPTION; BOND LENGTH; DENSITY FUNCTIONAL THEORY; ELECTROCHROMISM; LIGHT ABSORPTION; OPTICAL DATA STORAGE; PHOTOCHROMISM;

DERIVATIVES;

EID: 67650803239     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp900485p     Document Type: Article

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