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Examination of charge density waves in vertical excited states of a linear polyene

✍ Scribed by P. Karafiloglou; G. Kapsomenos


Book ID
113258378
Publisher
Elsevier Science
Year
1995
Tongue
English
Weight
647 KB
Volume
337
Category
Article
ISSN
0166-1280

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## Abstract Dressed Time‐Dependent Density Functional Theory (Maitra et al., J Chem Phys 2004, 120, 5932) is applied to selected linear polyenes. Limits of validity of the approximation are briefly discussed. The implementation strategy is described. Results for the 2^1^__B__~__u__~ and 2^1^__A__~_