Hydroxyflavone-containing polymers: theoretical prediction of spectral and nonlinear optical properties

• Published in: Functional Materials
• Date: 2019
• Main Authors: Mishurov, D., Voronkin, A., Roshal, A.
• Format: Article
• Language: English
• Published: НТК «Інститут монокристалів» НАН України 2019
• Subjects: Modeling and simulation
• Online Access: https://nasplib.isofts.kiev.ua/handle/123456789/157412
• Journal Title: Digital Library of Periodicals of National Academy of Sciences of Ukraine
• Cite this: Hydroxyflavone-containing polymers: theoretical prediction of spectral and nonlinear optical properties / D. Mishurov, A. Voronkin, A. Roshal // Functional Materials. — 2019. — Т. 26, № 1. — С. 164-173. — Бібліогр.: 29 назв. — англ.

In order to evaluate spectral and nonlinear optical (NLO) properties of polymers and polymer composites containing natural hydroxyflavones as chain fragments or dopants, a theoretical analysis of absorption spectra of flavones, as well as calculations of values of their first hyperpolarizabilities a...