Computational Engineering of Low Bandgap Copolymers

We present a conceptual approach to low bandgap copolymers, in which we clarify the physical parameters which control the optical bandgap, develop a fundamental understanding of bandgap tuning, unify the terminology, and outline the minimum requirements for accurate prediction of polymer bandgaps fr...

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Bibliographic Details
Main Authors: Michael eWykes, Begoña eMilián-Medina, Johannes eGierschner
Format: Article
Language:English
Published: Frontiers Media S.A. 2013-12-01
Series:Frontiers in Chemistry
Subjects:
Online Access:http://journal.frontiersin.org/Journal/10.3389/fchem.2013.00035/full