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Model calculations of the linear and non-linear optical properties of π-conjugated compounds

✍ Scribed by Meneghetti, M.

Book ID
122470066
Publisher
Elsevier Science
Year
1993
Tongue
English
Weight
343 KB
Volume
57
Category
Article
ISSN
0379-6779

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✍ D. Li; T.J. Marks; Mark A. Ratner 📂 Article 📅 1986 🏛 Elsevier Science 🌐 English ⚖ 449 KB

The vector (observable) part of the hyperpolarizability tensor for frequency doubling, b"\_( -2w; w, o), is calculated using perturbation theory and the PPP model Hamiltonian. Calculations for a dozen representative molecules show that this method yields results in excellent agreement with experimen