First Theoretical Framework of Triphenylamine–Dicyanovinylene-Based Nonlinear Optical Dyes: Structural Modification of π-Linkers

Usman Khan, Muhammad; Khalid, Muhammad; Ibrahim, Muhammad; Albert Carmo Braga, Ataualpa; Safdar, Muhammad; A. Al‐Saadi, Abdulaziz; Ramzan Saeed Ashraf Janjua, Muhammad

doi:10.1021/acs.jpcc.7b12293

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First Theoretical Framework of Triphenylamine–Dicyanovinylene-Based Nonlinear Optical Dyes: Structural Modification of π-Linkers

Shared by NobleBlocks on Jan 31, 2018 • 12:00 AM UTC

Authors:

Muhammad Usman Khan

Muhammad Khalid

Muhammad Ibrahim

Abstract

This work was inspired by a previous report [Janjua, M.R.S.A. Inorg. Chem. 2012, 51, 11306−11314] in which the nonlinear optical (NLO) response strikingly improved with double heteroaromatic rings. Herein, series of triphenylamine–dicyanovinylene based donor−π–acceptor dyes had been designed by stru...

Subject

Triphenylamine

Hyperpolarizability

Density functional theory

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